data_1d1o_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 1d1o _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 118.006 -0.997 . . . . 0.0 112.934 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.54 -48.04 22.11 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.975 1.783 . . . . 0.0 111.965 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.02 -47.65 76.7 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 123.328 0.651 . . . . 0.0 110.08 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -56.72 -50.19 72.94 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 mt -67.05 -37.01 83.29 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.225 0.61 . . . . 0.0 109.752 -175.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -60.32 -47.74 84.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.294 0.497 . . . . 0.0 110.525 172.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -56.18 -55.63 28.4 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -47.65 -63.92 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.657 1.183 . . . . 0.0 109.15 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -43.38 -55.73 3.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.503 1.521 . . . . 0.0 110.777 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.73 -48.59 79.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.956 0.903 . . . . 0.0 110.682 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -60.02 -47.4 86.0 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.048 -0.408 . . . . 0.0 111.009 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.36 -55.89 28.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.211 0.459 . . . . 0.0 110.977 174.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.88 -53.25 6.23 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.391 1.076 . . . . 0.0 112.013 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 178.231 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 mt -111.95 110.13 20.28 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.049 1.34 . . . . 0.0 111.01 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 m -62.84 159.96 15.55 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.411 -0.805 . . . . 0.0 109.42 167.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 1.2 mptp? -38.61 -50.56 1.61 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 124.305 1.042 . . . . 0.0 112.849 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.62 -41.15 98.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.469 0.176 . . . . 0.0 111.329 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -68.54 -44.79 73.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.88 -52.89 63.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -50.47 -56.27 12.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.153 0.581 . . . . 0.0 109.848 175.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -58.65 -45.91 88.27 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.867 1.267 . . . . 0.0 109.014 -169.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.2 tt -59.02 -55.45 34.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.79 -37.2 70.8 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.114 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.8 -51.85 66.59 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 119.285 0.948 . . . . 0.0 109.125 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -66.91 -51.76 51.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.416 -172.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -77.86 -40.56 39.74 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.541 0.737 . . . . 0.0 111.629 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 123.765 0.826 . . . . 0.0 112.859 -169.435 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.4 tp . . . . . 0 C--O 1.224 -0.271 0 CA-C-O 119.62 -0.229 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -55.92 -55.39 33.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.174 0.511 . . . . 0.0 110.356 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.09 -50.72 63.09 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.11 -57.09 12.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.827 0.851 . . . . 0.0 109.162 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.6 t80 -59.69 -43.52 94.03 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 118.072 0.396 . . . . 0.0 110.558 -179.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.97 -43.7 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.12 0.418 . . . . 0.0 111.1 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.71 -53.57 13.09 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.39 0.614 . . . . 0.0 109.548 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.26 -59.71 4.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.103 2.161 . . . . 0.0 109.738 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -81.08 45.15 0.81 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.527 0.731 . . . . 0.0 112.401 -169.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 124.068 0.947 . . . . 0.0 111.688 -169.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.773 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -127.21 139.27 53.05 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.388 1.475 . . . . 0.0 109.261 -172.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.93 111.02 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 124.943 1.297 . . . . 0.0 107.784 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -75.95 166.54 23.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -57.34 -32.22 66.51 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.32 0.581 . . . . 0.0 110.956 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -53.94 -55.49 26.57 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.866 0.866 . . . . 0.0 110.244 172.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -65.99 -41.27 91.3 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -56.01 -43.18 77.47 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.808 -0.557 . . . . 0.0 111.204 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -56.18 -30.21 61.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.531 -0.731 . . . . 0.0 112.039 176.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.8 -42.63 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.336 0.971 . . . . 0.0 110.283 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.65 -47.01 88.15 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 53.7 t . . . . . 0 CA--C 1.534 0.347 0 O-C-N 121.546 -0.721 . . . . 0.0 111.499 177.716 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 N--CA 1.451 -0.386 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.87 -48.04 23.48 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.817 1.678 . . . . 0.0 111.976 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.5 mp0 -65.73 -46.6 78.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.487 0.715 . . . . 0.0 110.141 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -57.8 -49.0 78.11 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mp -67.84 -33.01 73.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.523 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.25 -50.29 74.25 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.093 0.86 . . . . 0.0 110.175 169.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.97 -56.96 18.3 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.504 -1.039 . . . . 0.0 110.504 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.9 mt -44.16 -64.98 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.783 1.633 . . . . 0.0 110.01 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -43.14 -54.34 4.49 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.687 1.195 . . . . 0.0 109.662 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -59.1 -53.51 57.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.904 0.882 . . . . 0.0 111.448 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -63.65 -33.2 75.11 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 119.935 -0.706 . . . . 0.0 112.033 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -65.79 -60.62 2.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.853 0.752 . . . . 0.0 110.972 170.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.9 -41.02 4.92 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 125.614 1.565 . . . . 0.0 112.747 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 174.57 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.5 mt -115.94 107.77 15.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.894 0.878 . . . . 0.0 109.949 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.6 t -72.82 166.15 23.49 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 120.113 1.324 . . . . 0.0 109.718 169.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -38.78 -45.75 1.18 Allowed 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.742 1.617 . . . . 0.0 112.168 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.48 -48.54 81.24 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.056 0.389 . . . . 0.0 111.401 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.97 -40.95 75.08 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.24 -47.57 85.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.528 1.131 . . . . 0.0 108.993 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -59.2 -48.73 80.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.123 -0.985 . . . . 0.0 110.573 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.8 tp -52.36 -58.66 5.99 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 121.965 -0.46 . . . . 0.0 110.954 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.261 1.2 pt? -71.8 -33.86 68.91 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.12 -175.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.05 -42.79 93.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.169 1.35 . . . . 0.0 110.325 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -56.27 -53.82 52.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 119.499 1.045 . . . . 0.0 110.695 170.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -64.28 -51.52 63.09 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.413 -170.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -81.33 -40.15 24.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.165 0.986 . . . . 0.0 111.526 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 124.213 1.005 . . . . 0.0 111.631 -170.539 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--O 1.222 -0.349 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -56.96 -49.92 74.23 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 110.783 176.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -62.82 -55.09 29.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.331 0.586 . . . . 0.0 109.988 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.0 tp -48.95 -53.24 20.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.41 1.084 . . . . 0.0 109.361 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.36 -47.18 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.03 0.932 . . . . 0.0 110.659 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -55.96 -45.1 78.98 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.129 0.422 . . . . 0.0 110.922 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.27 -41.52 80.95 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.168 0.587 . . . . 0.0 110.851 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.48 -56.56 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 127.251 2.22 . . . . 0.0 109.51 -174.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.63 51.0 1.4 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.674 1.59 . . . . 0.0 111.832 -169.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.4 mttp . . . . . 0 CA--C 1.533 0.298 0 C-N-CA 124.617 1.167 . . . . 0.0 113.049 -169.703 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.64 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -137.44 132.13 32.95 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.068 0.947 . . . . 0.0 110.266 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.0 t -87.93 114.36 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 125.676 1.59 . . . . 0.0 109.167 -175.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.5 m -79.3 159.84 27.05 Favored 'General case' 0 C--N 1.335 -0.063 0 C-N-CA 123.823 0.849 . . . . 0.0 110.819 174.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -53.12 -33.79 53.86 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.478 0.656 . . . . 0.0 111.646 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 mp0 -56.26 -47.35 78.75 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.006 0.922 . . . . 0.0 110.144 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -75.67 -36.08 60.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -58.45 -42.38 87.25 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.61 -0.681 . . . . 0.0 110.33 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -57.15 -33.97 67.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.61 -1.306 . . . . 0.0 111.898 172.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.8 t -63.24 -45.73 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.402 1.001 . . . . 0.0 109.463 171.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.5 tp -51.3 -45.35 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.498 0.59 . . . . 0.0 110.42 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 CA--C 1.536 0.411 0 CA-C-N 118.845 0.748 . . . . 0.0 111.227 179.068 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.09 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -52.2 -46.17 34.49 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.088 1.859 . . . . 0.0 111.861 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.02 -44.87 79.19 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.764 0.826 . . . . 0.0 110.031 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.13 -50.88 71.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -65.27 -38.56 90.67 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.269 0.628 . . . . 0.0 110.106 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -56.32 -54.51 44.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 170.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.9 -55.09 22.56 Favored Glycine 0 CA--C 1.529 0.908 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.46 -61.5 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.342 1.057 . . . . 0.0 109.521 175.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -45.16 -53.6 7.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.395 1.078 . . . . 0.0 110.654 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -60.85 -48.39 82.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.338 0.655 . . . . 0.0 110.539 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.53 -44.72 93.12 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.893 0.315 . . . . 0.0 111.04 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -58.29 -62.48 1.8 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.758 0.254 . . . . 0.0 110.829 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.48 -52.24 6.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.154 1.382 . . . . 0.0 112.092 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 114.245 -177.551 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.185 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -119.11 116.64 26.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.983 1.713 . . . . 0.0 109.978 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 95.7 p -63.11 169.52 3.38 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.024 -1.047 . . . . 0.0 110.204 169.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -45.73 -43.2 12.68 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.37 -0.832 . . . . 0.0 111.365 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.18 -47.69 73.14 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.226 -0.296 . . . . 0.0 110.412 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.94 -41.74 99.59 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.853 -0.529 . . . . 0.0 109.977 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.5 -49.74 76.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.571 1.548 . . . . 0.0 110.129 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -62.38 -40.77 97.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.121 175.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.9 -57.2 13.55 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 121.531 -0.731 . . . . 0.0 111.098 -178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.4 pt? -69.4 -35.79 76.12 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 119.229 -0.988 . . . . 0.0 112.113 -176.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.86 -40.73 95.6 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 119.453 1.024 . . . . 0.0 110.676 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -57.21 -52.19 66.33 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.468 1.031 . . . . 0.0 110.954 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -61.25 -56.05 25.02 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 110.698 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -83.31 -36.6 24.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.502 1.121 . . . . 0.0 111.799 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 . . . . . 0 CA--C 1.536 0.414 0 C-N-CA 123.678 0.791 . . . . 0.0 112.247 -172.443 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.224 -0.283 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.23 -50.67 68.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.597 0.359 . . . . 0.0 110.414 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.3 mp0 -66.69 -50.24 63.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.3 tt -50.57 -57.98 6.89 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -52.65 -50.73 62.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.258 1.023 . . . . 0.0 110.928 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -54.53 -42.44 70.89 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.848 0.749 . . . . 0.0 111.611 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -72.04 -20.04 61.74 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.52 0.328 . . . . 0.0 111.607 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -90.75 -58.59 2.43 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.922 1.289 . . . . 0.0 110.206 -176.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -78.81 43.32 0.49 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.513 1.925 . . . . 0.0 113.311 -167.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 CA--C 1.535 0.404 0 C-N-CA 124.178 0.991 . . . . 0.0 111.852 -169.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.87 0 CA-C-O 119.419 -0.656 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -138.11 138.49 38.75 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.778 0.831 . . . . 0.0 110.222 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.7 t -88.72 116.61 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 C-N-CA 127.106 2.162 . . . . 0.0 109.826 -172.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.9 p -70.13 168.32 15.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.742 0.817 . . . . 0.0 111.471 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -60.92 -35.56 77.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.596 0.713 . . . . 0.0 109.676 169.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -58.9 -51.99 67.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.005 0.922 . . . . 0.0 109.094 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -65.98 -40.18 91.01 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.359 0.599 . . . . 0.0 110.247 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -60.4 -34.0 73.29 Favored 'General case' 0 C--O 1.216 -0.697 0 O-C-N 121.375 -0.828 . . . . 0.0 111.479 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.6 -35.06 73.58 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.03 -1.669 . . . . 0.0 111.703 170.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.5 t -62.75 -42.39 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 121.038 -1.039 . . . . 0.0 108.739 169.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.51 -43.49 68.34 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.403 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 CA--C 1.534 0.33 0 CA-C-N 120.139 1.336 . . . . 0.0 110.289 177.76 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 118.231 -0.89 . . . . 0.0 113.221 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.68 -47.81 19.65 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 121.783 1.656 . . . . 0.0 112.323 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -69.62 -43.33 72.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.862 0.465 . . . . 0.0 110.332 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -54.69 -54.46 41.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.086 0.47 . . . . 0.0 109.775 177.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.07 -34.46 76.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.621 -177.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -57.78 -50.12 74.31 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 119.67 1.123 . . . . 0.0 110.558 172.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.23 -53.84 41.67 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 23.4 mt -49.45 -62.27 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -45.99 -57.18 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.007 1.323 . . . . 0.0 111.165 -177.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -66.13 -36.2 82.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.326 -0.369 . . . . 0.0 111.215 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -63.5 -49.21 74.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.672 0.669 . . . . 0.0 110.005 176.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -57.8 -52.65 64.58 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.717 -0.615 . . . . 0.0 111.363 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.61 -57.74 3.95 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.031 0.532 . . . . 0.0 110.626 172.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 123.23 0.612 . . . . 0.0 112.626 177.077 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 CA--C 1.536 0.414 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.6 mt -109.2 108.93 19.74 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.809 1.244 . . . . 0.0 110.532 -173.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.4 t -70.79 165.8 22.35 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 119.43 1.014 . . . . 0.0 110.698 169.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtmt -38.24 -51.22 1.47 Allowed 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 126.222 1.809 . . . . 0.0 112.378 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.0 mp0 -65.41 -39.44 92.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.77 -0.157 . . . . 0.0 110.709 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.74 -42.0 74.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.53 -48.68 80.06 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.574 -0.158 . . . . 0.0 110.574 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.85 -52.17 66.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.301 -0.874 . . . . 0.0 109.433 177.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 tp -51.28 -60.34 3.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 123.349 0.406 . . . . 0.0 110.363 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.281 0.9 OUTLIER -69.94 -32.33 70.54 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 119.126 -1.03 . . . . 0.0 112.467 -173.435 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.81 -44.95 84.1 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 119.962 1.255 . . . . 0.0 110.48 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -48.53 80.46 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.99 0.359 . . . . 0.0 110.289 176.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -64.81 -53.47 46.4 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.428 0.156 . . . . 0.0 110.695 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -83.8 -41.21 17.8 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.237 0.615 . . . . 0.0 111.432 -171.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 CA--C 1.541 0.606 0 CA-C-N 118.55 0.614 . . . . 0.0 111.962 -174.073 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.0 tp . . . . . 0 C--O 1.222 -0.38 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.36 -53.55 52.44 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 118.258 0.481 . . . . 0.0 110.562 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.17 -49.6 64.12 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -55.61 -52.68 62.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -57.78 -44.71 86.4 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.533 0.733 . . . . 0.0 110.419 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.35 -41.07 88.37 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.069 0.395 . . . . 0.0 111.149 178.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -68.85 -46.6 68.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.671 0.748 . . . . 0.0 109.272 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.77 -54.77 8.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.324 1.45 . . . . 0.0 110.672 -170.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.55 48.23 1.03 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.514 1.126 . . . . 0.0 112.886 -168.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.2 mttp . . . . . 0 CA--C 1.532 0.274 0 C-N-CA 125.429 1.491 . . . . 0.0 112.694 -169.845 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.687 0 N-CA-C 108.431 -1.867 . . . . 0.0 108.431 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -151.77 135.72 16.49 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 112.11 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.2 t -88.08 116.13 29.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 127.269 2.228 . . . . 0.0 110.335 -168.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 89.4 p -67.59 164.69 18.54 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.151 0.98 . . . . 0.0 111.075 175.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -58.92 -37.67 77.19 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.22 0.533 . . . . 0.0 110.368 170.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -56.52 -54.82 41.41 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.193 0.597 . . . . 0.0 110.26 175.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -61.49 -43.43 98.88 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.035 0.445 . . . . 0.0 110.013 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.49 -41.74 77.15 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 122.058 -0.401 . . . . 0.0 111.002 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -58.31 -27.6 64.24 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.119 -0.988 . . . . 0.0 112.345 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.72 -43.02 97.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.633 1.106 . . . . 0.0 109.497 170.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -58.99 -46.75 87.39 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 172.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 CA--C 1.535 0.391 0 O-C-N 120.998 -1.064 . . . . 0.0 111.176 175.361 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 118.35 -0.833 . . . . 0.0 112.642 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -56.59 -37.33 97.76 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 CA-C-N 120.881 1.35 . . . . 0.0 111.241 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -64.86 -51.54 61.46 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 122.654 0.381 . . . . 0.0 110.904 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -65.66 -38.89 90.59 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.451 -0.781 . . . . 0.0 109.11 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.13 -30.73 71.28 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.254 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -59.32 -46.51 88.38 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 120.346 1.43 . . . . 0.0 109.321 169.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.97 -56.8 16.94 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.5 mt -50.02 -63.18 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 123.391 0.676 . . . . 0.0 109.637 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -43.01 -52.79 5.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.423 1.889 . . . . 0.0 110.675 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.4 -50.57 73.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.221 1.009 . . . . 0.0 110.376 -178.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -60.57 -40.39 91.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.126 -0.359 . . . . 0.0 111.449 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -61.55 -60.8 3.15 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.321 0.509 . . . . 0.0 111.811 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.77 -53.8 2.77 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.924 1.29 . . . . 0.0 111.613 177.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 C-N-CA 124.682 1.193 . . . . 0.0 113.673 -179.513 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 73.4 mt -115.48 108.12 16.06 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.107 1.363 . . . . 0.0 110.311 -178.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -63.63 159.5 18.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.166 -0.959 . . . . 0.0 109.749 168.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -39.18 -46.83 1.53 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.616 1.166 . . . . 0.0 113.071 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -61.09 -43.95 98.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 117.761 0.255 . . . . 0.0 111.389 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -68.69 -42.42 77.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.46 -47.34 85.86 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -56.79 -50.28 72.81 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.484 -0.76 . . . . 0.0 109.709 175.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -53.03 -57.34 10.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.656 0.382 . . . . 0.0 111.627 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.0 OUTLIER -73.44 -33.63 65.02 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 119.286 0.948 . . . . 0.0 112.472 -176.79 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.18 -38.74 92.37 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 120.691 1.587 . . . . 0.0 109.387 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.24 -50.8 71.59 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.956 -0.465 . . . . 0.0 111.413 171.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -68.57 -47.68 66.19 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.788 -171.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -88.65 -39.52 13.98 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.334 1.053 . . . . 0.0 111.466 -170.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 118.742 0.701 . . . . 0.0 112.689 -171.983 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 C--O 1.222 -0.388 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -55.28 -54.39 44.09 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.279 0.945 . . . . 0.0 110.505 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mp0 -65.8 -50.81 63.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.41 0.684 . . . . 0.0 109.708 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.7 tp -51.96 -55.59 19.44 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -53.45 -49.07 68.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.119 1.368 . . . . 0.0 110.728 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -53.89 -43.3 69.54 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.735 0.243 . . . . 0.0 111.282 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -76.09 -43.42 43.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 111.277 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 tt -55.48 -56.15 23.58 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.776 1.63 . . . . 0.0 109.435 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -80.24 45.8 0.78 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.098 1.359 . . . . 0.0 113.209 -168.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 tptt . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 122.029 0.919 . . . . 0.0 111.137 -177.145 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.847 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -135.17 133.01 38.69 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.74 1.216 . . . . 0.0 108.448 173.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 29.4 t -86.88 112.33 22.88 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.8 p -78.67 162.19 26.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.547 0.739 . . . . 0.0 109.857 172.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -54.7 -31.61 58.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.311 0.577 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -51.43 -55.97 15.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.819 0.848 . . . . 0.0 110.543 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -72.98 -35.18 66.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -56.85 -42.82 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.698 -0.626 . . . . 0.0 110.663 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.07 -34.43 68.27 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.072 -1.017 . . . . 0.0 111.812 174.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.2 t -61.38 -42.83 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.432 1.014 . . . . 0.0 109.386 172.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.5 -45.99 80.75 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.673 -0.642 . . . . 0.0 109.882 171.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 CA--C 1.536 0.423 0 O-C-N 121.097 -1.002 . . . . 0.0 111.378 175.815 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 117.663 -1.161 . . . . 0.0 113.895 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.13 -52.76 8.3 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 121.914 1.743 . . . . 0.0 112.385 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -73.58 -39.39 64.69 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.591 0.356 . . . . 0.0 110.606 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.78 -54.4 44.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.2 mp -71.54 -28.04 63.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.86 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.9 -51.2 70.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.437 1.017 . . . . 0.0 108.781 168.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.47 -54.84 27.89 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 176.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.02 -61.27 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.849 0.859 . . . . 0.0 109.789 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -45.88 -54.54 8.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.24 1.416 . . . . 0.0 110.244 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.95 -43.71 98.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -64.76 -43.16 94.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.614 1.097 . . . . 0.0 111.638 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.8 -57.36 12.35 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.299 0.954 . . . . 0.0 111.098 171.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -51.26 7.28 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.322 1.049 . . . . 0.0 111.883 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.705 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 . . . . . 0 CA--C 1.535 0.379 0 CA-C-O 119.493 -0.289 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.8 mt -119.57 131.99 55.64 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.814 1.246 . . . . 0.0 110.099 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.4 p -72.92 172.6 10.62 Favored 'General case' 0 C--O 1.224 -0.277 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 167.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.401 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -57.03 -33.26 67.01 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 121.072 -1.018 . . . . 0.0 112.26 168.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -65.16 -53.33 46.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.458 0.572 . . . . 0.0 110.134 174.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -61.6 -39.85 92.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.75 -47.69 84.65 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.349 0.659 . . . . 0.0 110.263 175.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -55.57 -48.45 74.78 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.305 -0.872 . . . . 0.0 109.679 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.31 -66.62 0.37 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.578 0.751 . . . . 0.0 110.065 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.265 1.2 pt? -70.21 -29.94 66.91 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.573 -172.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -66.75 -44.5 81.3 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 120.516 1.507 . . . . 0.0 110.581 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.54 -49.39 76.89 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.311 0.505 . . . . 0.0 110.262 174.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.3 m -65.97 -50.89 62.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.171 -173.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -84.41 -40.67 17.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.843 0.857 . . . . 0.0 111.657 -173.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.594 -177.135 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 C--O 1.221 -0.428 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.55 -58.93 4.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.148 0.499 . . . . 0.0 110.41 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.94 -49.99 70.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.965 0.506 . . . . 0.0 109.737 -175.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -51.57 -55.0 21.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.763 0.825 . . . . 0.0 108.906 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.401 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.2 t80 -56.58 -47.39 79.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.645 0.778 . . . . 0.0 110.992 178.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.42 -40.31 86.29 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.543 0.61 . . . . 0.0 111.284 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 68.0 tt0 -68.91 -45.99 69.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.688 0.756 . . . . 0.0 109.269 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.54 -51.51 55.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.554 1.542 . . . . 0.0 110.591 -175.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -74.49 72.35 1.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.725 1.21 . . . . 0.0 109.548 -174.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.2 tttp . . . . . 0 CA--C 1.534 0.337 0 C-N-CA 125.156 1.382 . . . . 0.0 111.506 179.203 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.088 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -154.14 155.72 35.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.948 1.699 . . . . 0.0 107.326 -169.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.8 t -125.2 113.37 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.063 1.345 . . . . 0.0 109.016 -175.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.2 p -69.93 168.09 16.05 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 124.339 1.056 . . . . 0.0 110.857 170.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -56.49 -42.02 77.59 Favored 'General case' 0 C--N 1.342 0.246 0 O-C-N 121.865 -0.522 . . . . 0.0 109.961 169.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -58.89 -49.44 77.77 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.23 0.612 . . . . 0.0 109.585 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.36 -45.99 92.08 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.195 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -52.98 -40.55 63.83 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 122.05 -0.406 . . . . 0.0 111.094 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -55.39 -31.87 62.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.212 -0.93 . . . . 0.0 111.844 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.8 t -64.2 -35.11 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.473 -0.767 . . . . 0.0 110.168 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -66.36 -45.21 80.89 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.475 -0.765 . . . . 0.0 109.143 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 CA--C 1.533 0.307 0 CA-C-N 118.086 0.403 . . . . 0.0 110.813 178.759 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.409 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.636 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -44.64 -40.28 13.93 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.838 2.359 . . . . 0.0 114.163 171.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -71.66 -41.26 68.95 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.178 0.444 . . . . 0.0 109.823 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.57 -51.3 69.11 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.08 -39.3 85.61 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.661 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.48 -51.81 67.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 119.009 0.822 . . . . 0.0 110.443 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.12 -54.56 30.92 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.2 mt -49.78 -63.07 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -43.45 -57.24 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.149 1.38 . . . . 0.0 111.007 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.48 -36.66 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.767 -174.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -62.08 -47.54 84.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.26 0.482 . . . . 0.0 110.786 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -58.43 -55.45 34.89 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.594 0.634 . . . . 0.0 111.008 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -54.26 7.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.617 0.767 . . . . 0.0 111.515 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 178.265 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.222 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -117.24 109.03 16.37 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.41 1.484 . . . . 0.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.1 m -59.75 156.06 14.73 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.856 0.753 . . . . 0.0 109.1 167.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.438 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -45.87 -39.89 9.22 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -72.96 -34.02 66.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.02 0.827 . . . . 0.0 111.529 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.88 -49.23 73.52 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 174.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.72 -48.67 77.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.888 -0.507 . . . . 0.0 109.928 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -53.59 -57.67 9.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.133 0.424 . . . . 0.0 110.716 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.26 -33.56 69.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.5 tt -56.64 -59.09 5.51 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -54.66 -42.93 71.92 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.413 -0.805 . . . . 0.0 111.538 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -62.4 -49.7 74.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.432 0.56 . . . . 0.0 110.115 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.0 m -69.51 -48.94 58.91 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.932 0.396 . . . . 0.0 110.023 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -81.85 -41.23 21.31 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 118.318 -0.849 . . . . 0.0 111.742 -169.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 . . . . . 0 CA--C 1.541 0.63 0 CA-C-N 119.273 0.942 . . . . 0.0 112.018 -170.038 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp . . . . . 0 C--O 1.222 -0.374 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -54.17 -53.44 53.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.983 0.42 . . . . 0.0 110.6 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -63.95 -53.59 47.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -51.67 -55.79 17.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.023 0.529 . . . . 0.0 109.714 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.438 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 16.9 t80 -55.66 -47.86 75.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.835 0.854 . . . . 0.0 110.754 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -56.42 -39.99 73.97 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.025 0.375 . . . . 0.0 111.932 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -49.07 17.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 109.937 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 tt -62.26 -56.81 14.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.932 1.693 . . . . 0.0 109.615 -174.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -80.87 43.61 0.7 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.965 0.906 . . . . 0.0 112.293 -169.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt . . . . . 0 CA--C 1.533 0.295 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -168.546 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -134.64 141.1 46.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.038 0.935 . . . . 0.0 109.548 173.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.5 t -88.55 120.36 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 C-N-CA 125.209 1.404 . . . . 0.0 109.529 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -71.86 163.47 27.77 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 123.946 0.898 . . . . 0.0 111.107 172.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -58.52 -35.13 71.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.861 0.838 . . . . 0.0 109.876 170.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.77 -51.68 68.3 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.439 1.096 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.36 -44.5 94.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.95 0.405 . . . . 0.0 110.123 174.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -53.96 -44.3 70.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.399 0.68 . . . . 0.0 110.889 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -55.03 -31.3 60.97 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.34 -0.85 . . . . 0.0 112.396 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.57 -37.8 79.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 119.013 0.824 . . . . 0.0 110.262 172.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.37 -50.27 70.59 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.2 t . . . . . 0 CA--C 1.533 0.302 0 CA-C-N 117.86 0.3 . . . . 0.0 111.071 -177.097 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 118.225 -0.893 . . . . 0.0 112.685 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -49.67 -49.62 15.35 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.367 2.045 . . . . 0.0 112.786 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.05 -39.24 79.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.497 0.319 . . . . 0.0 110.585 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.86 -52.29 65.7 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 174.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 23.3 mt -63.75 -39.58 94.63 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.283 1.033 . . . . 0.0 110.569 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -58.15 -52.86 63.8 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.243 0.617 . . . . 0.0 110.4 172.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.3 -55.14 28.06 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.4 mt -43.62 -64.83 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.028 1.331 . . . . 0.0 109.455 171.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -45.59 -53.29 9.34 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.61 1.164 . . . . 0.0 110.7 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.51 -48.61 80.97 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.903 0.481 . . . . 0.0 110.977 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.96 -43.45 95.04 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 122.004 -0.435 . . . . 0.0 111.167 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -62.02 -58.44 7.84 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 111.081 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.17 -53.07 5.24 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.102 0.961 . . . . 0.0 111.928 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.352 0 C-N-CA 124.376 1.071 . . . . 0.0 113.646 179.658 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.4 mt -112.02 119.04 37.12 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.814 1.646 . . . . 0.0 109.622 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -61.91 169.19 2.71 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.834 1.197 . . . . 0.0 109.752 168.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -52.24 -36.96 53.87 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.004 -1.06 . . . . 0.0 111.875 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.24 -51.06 63.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.16 -41.94 97.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.48 -48.63 80.25 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.867 1.267 . . . . 0.0 109.605 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 tttp -58.38 -51.16 70.99 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -49.03 -61.99 1.77 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.339 1.055 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.277 1.0 OUTLIER -68.09 -32.73 73.25 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.322 -175.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -63.39 -46.77 84.9 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 119.925 1.238 . . . . 0.0 110.449 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -56.09 -52.37 64.55 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.025 173.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.0 m -66.52 -47.97 71.23 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.039 -170.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -87.56 -41.55 13.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.576 0.75 . . . . 0.0 111.981 -172.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 C--O 1.233 0.236 0 CA-C-N 118.67 0.668 . . . . 0.0 110.671 -169.198 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.7 tp . . . . . 0 C--O 1.223 -0.319 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -53.55 -55.55 24.59 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.354 0.597 . . . . 0.0 110.937 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.01 -49.07 63.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.483 0.713 . . . . 0.0 109.45 -174.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.07 -59.13 4.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.698 0.799 . . . . 0.0 108.976 177.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -56.85 -43.68 81.4 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.032 0.533 . . . . 0.0 110.804 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.51 -42.75 78.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.037 0.38 . . . . 0.0 111.19 176.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -71.12 -38.38 72.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.189 0.596 . . . . 0.0 110.174 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.87 -51.21 42.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.934 1.694 . . . . 0.0 110.406 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -78.76 66.95 4.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.016 0.927 . . . . 0.0 109.38 -169.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 CA--C 1.533 0.296 0 C-N-CA 126.719 2.007 . . . . 0.0 109.997 179.605 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.082 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -142.93 163.14 33.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.553 1.941 . . . . 0.0 107.017 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.4 t -119.59 115.71 48.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 125.988 1.715 . . . . 0.0 108.243 -173.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.8 p -81.1 163.71 22.95 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 124.238 1.015 . . . . 0.0 110.565 176.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -55.07 -32.95 62.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.119 0.485 . . . . 0.0 111.025 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.99 -34.25 77.15 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.015 0.926 . . . . 0.0 112.069 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -82.74 -42.09 18.43 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -57.6 -44.04 85.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.816 0.846 . . . . 0.0 111.262 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -60.48 -24.67 65.46 Favored 'General case' 0 CA--C 1.529 0.137 0 O-C-N 120.754 -1.216 . . . . 0.0 112.427 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.31 -48.14 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 C-N-CA 119.747 -0.781 . . . . 0.0 108.919 170.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -48.81 -42.48 36.16 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.129 -0.357 . . . . 0.0 110.447 172.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.0 111.792 179.647 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.896 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.89 -48.96 14.75 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.563 2.176 . . . . 0.0 112.38 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.86 -46.49 84.75 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.812 0.845 . . . . 0.0 110.184 -178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -57.5 -48.26 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.4 mt -63.24 -39.73 95.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.735 0.814 . . . . 0.0 110.449 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -54.86 -53.17 58.86 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.517 0.727 . . . . 0.0 109.826 170.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.06 -55.7 26.81 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.0 mt -46.8 -61.25 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 124.302 1.041 . . . . 0.0 109.114 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -46.63 -56.8 5.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.637 0.775 . . . . 0.0 110.964 -178.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -55.04 -47.12 75.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.72 0.408 . . . . 0.0 111.605 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -59.81 -47.18 86.76 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.948 -0.47 . . . . 0.0 111.023 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -61.59 -53.94 49.54 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 118.487 0.585 . . . . 0.0 110.933 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.99 -52.92 8.3 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.302 0.641 . . . . 0.0 112.02 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 176.805 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 119.612 -0.232 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -114.76 108.35 16.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.377 0.671 . . . . 0.0 110.342 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.7 t -65.77 161.55 20.61 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 168.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 67.4 mttm -38.66 -51.08 1.66 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.625 1.17 . . . . 0.0 113.042 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -66.79 -41.49 87.56 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.63 -42.94 95.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.0 tp -56.2 -61.78 2.16 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 172.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -46.59 -46.15 19.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.538 1.063 . . . . 0.0 111.732 -178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.4 -29.36 68.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.676 1.19 . . . . 0.0 109.741 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 tt -79.32 -58.65 3.11 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.95 -60.94 1.96 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.928 2.091 . . . . 0.0 111.914 -170.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.18 -46.63 79.29 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -177.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -65.69 -49.61 67.9 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 111.704 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -83.03 -36.09 25.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.08 -171.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 CA--C 1.538 0.516 0 C-N-CA 123.583 0.753 . . . . 0.0 110.685 -173.014 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp . . . . . 0 C--O 1.223 -0.336 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -60.29 -46.23 90.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -176.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.39 -54.85 40.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.1 tp -50.36 -55.84 13.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.968 0.507 . . . . 0.0 109.749 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.405 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 12.5 t80 -51.16 -48.48 61.85 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.101 0.961 . . . . 0.0 111.074 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.08 -44.52 94.72 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.367 0.53 . . . . 0.0 111.241 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.85 -36.77 80.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.301 0.64 . . . . 0.0 110.814 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.36 -56.81 4.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.985 1.714 . . . . 0.0 109.774 -173.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -80.17 48.75 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.933 1.693 . . . . 0.0 112.605 -168.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -170.288 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -136.36 129.25 31.02 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.633 1.173 . . . . 0.0 109.246 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.37 115.05 27.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -84.23 156.44 22.0 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.994 1.318 . . . . 0.0 109.99 178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -55.23 -31.94 61.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.477 0.656 . . . . 0.0 111.985 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -57.01 -43.97 82.36 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.868 0.867 . . . . 0.0 110.555 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -77.63 -38.71 47.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -59.78 -37.4 78.97 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 121.676 -0.64 . . . . 0.0 110.715 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -56.59 -34.1 66.86 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.303 -1.498 . . . . 0.0 112.117 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -64.09 -44.76 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.283 0.947 . . . . 0.0 109.022 170.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -51.75 -41.82 61.88 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.799 -0.563 . . . . 0.0 110.558 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 CA--C 1.537 0.466 0 CA-C-N 119.339 0.972 . . . . 0.0 111.615 178.199 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.276 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.4 -47.24 28.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.016 1.811 . . . . 0.0 112.046 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -68.04 -43.28 79.06 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.625 0.77 . . . . 0.0 110.02 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.36 -52.02 64.89 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.551 0.74 . . . . 0.0 109.239 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.5 mt -64.25 -37.35 87.18 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.236 0.614 . . . . 0.0 110.427 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -57.96 -48.28 80.42 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.597 0.635 . . . . 0.0 110.312 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.9 -55.56 27.21 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 177.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -50.21 -62.21 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.721 0.808 . . . . 0.0 109.417 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -43.25 -54.53 4.5 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 125.032 1.333 . . . . 0.0 110.443 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.2 -46.82 88.91 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.253 1.021 . . . . 0.0 110.449 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.71 -45.7 93.2 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.226 -0.296 . . . . 0.0 110.927 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -58.14 -58.79 6.89 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.075 0.398 . . . . 0.0 111.396 173.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.77 -53.04 7.82 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.318 1.447 . . . . 0.0 111.724 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 177.228 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 . . . . . 0 N--CA 1.468 0.434 0 N-CA-C 117.453 2.39 . . . . 0.0 117.453 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 59.7 mt -111.23 126.22 54.64 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.3 1.44 . . . . 0.0 110.467 176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.5 p -71.99 171.32 12.05 Favored 'General case' 0 C--O 1.224 -0.249 0 O-C-N 121.307 -0.87 . . . . 0.0 109.513 169.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -47.85 -45.3 30.01 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.104 0.866 . . . . 0.0 111.207 168.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.16 -52.04 65.41 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -61.2 -42.18 98.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.292 0.568 . . . . 0.0 110.361 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.92 -48.95 79.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.77 1.628 . . . . 0.0 109.691 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -59.56 -47.67 84.64 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.343 -0.848 . . . . 0.0 110.272 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.9 tp -52.09 -59.79 3.95 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.016 0.926 . . . . 0.0 111.208 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.3 pt? -68.77 -34.86 76.28 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.82 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.41 -43.45 94.35 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.628 1.104 . . . . 0.0 110.679 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -55.27 -53.98 49.23 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 119.639 1.109 . . . . 0.0 110.466 172.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -65.38 -54.24 31.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.014 -169.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -81.43 -37.63 27.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.475 0.71 . . . . 0.0 111.728 -174.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 112.549 -168.596 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.26 -50.16 72.12 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.539 0.336 . . . . 0.0 110.323 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.08 -53.39 50.4 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.468 0.707 . . . . 0.0 109.892 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.3 tp -50.43 -57.72 7.36 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.541 0.736 . . . . 0.0 109.254 178.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -52.73 -48.87 66.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.957 0.903 . . . . 0.0 111.322 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -55.92 -46.13 78.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.538 0.608 . . . . 0.0 111.209 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -71.14 -40.6 71.26 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 121.025 0.441 . . . . 0.0 110.593 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.64 -55.89 25.76 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.305 1.442 . . . . 0.0 109.442 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -80.81 51.72 1.58 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.184 1.794 . . . . 0.0 111.85 -169.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 mttm . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.371 1.069 . . . . 0.0 113.412 -169.425 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.748 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -134.0 127.96 33.39 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.736 1.214 . . . . 0.0 108.946 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.7 t -87.26 114.14 25.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 125.236 1.414 . . . . 0.0 108.694 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.5 m -77.75 154.31 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -48.24 -41.01 26.4 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.446 0.641 . . . . 0.0 111.571 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -64.46 -36.09 83.06 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.067 0.547 . . . . 0.0 110.601 -177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -74.75 -44.7 48.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -51.37 -40.62 59.59 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.496 0.718 . . . . 0.0 110.474 174.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -55.37 -32.93 63.0 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.647 -0.658 . . . . 0.0 111.903 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.57 -41.85 91.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.186 -0.946 . . . . 0.0 109.719 172.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.09 -44.32 97.53 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.5 t . . . . . 0 CA--C 1.534 0.341 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 176.927 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.45 -0.443 0 CA-C-O 118.057 -0.973 . . . . 0.0 113.589 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.17 -46.8 21.43 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.814 1.676 . . . . 0.0 112.061 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -72.34 -38.53 68.58 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.801 0.441 . . . . 0.0 110.646 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.72 -55.36 33.12 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.998 -0.438 . . . . 0.0 110.013 174.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.69 -33.53 76.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.3 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -56.9 -50.72 71.67 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.261 0.937 . . . . 0.0 110.517 170.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.65 -52.32 49.04 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -51.95 -62.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.775 0.83 . . . . 0.0 109.519 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -42.47 -55.47 3.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.643 1.177 . . . . 0.0 110.179 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -57.86 -52.45 65.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.904 0.881 . . . . 0.0 111.752 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -62.11 -38.66 89.75 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.769 -0.772 . . . . 0.0 111.72 -176.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -61.98 -60.56 3.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.595 0.634 . . . . 0.0 111.189 169.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.91 -48.14 16.23 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.609 1.564 . . . . 0.0 113.498 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 C-N-CA 124.859 1.264 . . . . 0.0 113.41 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 116.738 2.125 . . . . 0.0 116.738 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.8 mt -113.81 123.12 49.05 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.169 1.788 . . . . 0.0 110.234 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.9 p -66.0 167.23 10.13 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.1 -1.0 . . . . 0.0 110.147 169.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 60.2 mtpt -43.56 -47.56 7.39 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.38 -0.825 . . . . 0.0 111.709 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -67.25 -46.84 72.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -176.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -62.02 -44.99 95.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.197 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.58 -49.42 77.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.15 -53.8 38.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.934 0.788 . . . . 0.0 110.084 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.28 -51.15 71.17 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.265 1.026 . . . . 0.0 108.531 -170.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tt -56.58 -55.77 29.74 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.135 -1.393 . . . . 0.0 108.378 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.79 -40.75 73.13 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.981 0.809 . . . . 0.0 111.227 -177.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.7 -49.78 73.73 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.218 0.917 . . . . 0.0 109.076 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.5 m -66.35 -51.51 56.43 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.709 -173.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -83.9 -41.64 17.2 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.259 1.024 . . . . 0.0 111.535 -172.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 . . . . . 0 CA--C 1.539 0.552 0 C-N-CA 124.145 0.978 . . . . 0.0 111.78 -170.217 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp . . . . . 0 C--O 1.22 -0.467 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -56.06 -49.51 73.58 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.037 0.446 . . . . 0.0 109.874 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.09 -54.66 34.38 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.305 0.642 . . . . 0.0 110.125 -179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.4 tp -54.77 -56.04 23.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.445 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 19.2 t80 -52.87 -47.0 68.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.699 1.199 . . . . 0.0 110.782 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -58.38 -41.21 84.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.93 0.332 . . . . 0.0 111.077 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -71.69 -39.23 70.36 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.349 0.595 . . . . 0.0 110.462 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -74.05 -55.44 6.11 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.919 1.688 . . . . 0.0 110.443 -171.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -79.19 40.3 0.41 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.697 1.199 . . . . 0.0 113.814 -167.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.17 0 O-C-N 121.165 -0.96 . . . . 0.0 111.577 -172.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.771 0 N-CA-C 111.866 -0.493 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -138.07 136.78 37.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.189 0.996 . . . . 0.0 109.813 -176.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.76 117.26 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 126.464 1.905 . . . . 0.0 109.186 -172.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -81.66 156.4 25.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.171 0.988 . . . . 0.0 110.343 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -52.9 -38.28 61.57 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 118.589 0.631 . . . . 0.0 111.005 -175.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -61.02 -39.83 91.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.4 0.68 . . . . 0.0 110.379 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.51 -44.36 62.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -54.55 -39.32 67.59 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 122.882 0.473 . . . . 0.0 111.199 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -58.98 -27.5 65.46 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.168 -0.958 . . . . 0.0 111.469 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -63.31 -44.67 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.318 -0.864 . . . . 0.0 109.203 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.9 tp -56.3 -47.1 79.34 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 171.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 49.3 t . . . . . 0 CA--C 1.538 0.486 0 CA-C-N 119.765 1.166 . . . . 0.0 111.362 178.456 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 118.358 -0.829 . . . . 0.0 112.762 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.59 -46.22 34.78 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.018 1.812 . . . . 0.0 111.915 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.4 mp0 -67.39 -43.17 81.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.575 0.75 . . . . 0.0 110.264 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.19 -52.18 65.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.87 -37.12 83.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.46 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -56.47 -51.85 66.91 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 119.112 0.869 . . . . 0.0 110.649 171.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.44 -55.02 30.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -49.18 -59.77 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.762 0.825 . . . . 0.0 109.39 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -48.2 -57.91 5.26 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.929 1.292 . . . . 0.0 110.392 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -54.6 -46.42 73.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.302 0.641 . . . . 0.0 111.399 179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -59.29 -48.94 79.72 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.927 -0.483 . . . . 0.0 110.951 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.05 -56.82 17.32 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.055 0.388 . . . . 0.0 111.216 175.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.21 -53.93 3.88 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.852 1.261 . . . . 0.0 111.365 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -179.599 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.8 mt -107.11 108.91 20.6 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.996 0.918 . . . . 0.0 110.795 -175.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -64.94 163.57 14.26 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.051 -1.03 . . . . 0.0 109.136 167.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -38.63 -42.71 0.81 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.811 1.644 . . . . 0.0 112.073 174.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.48 -45.83 82.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.305 -0.247 . . . . 0.0 111.59 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -62.72 -48.17 80.38 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 175.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.18 -47.65 80.69 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.79 0.836 . . . . 0.0 110.376 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -46.87 86.17 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.545 -0.722 . . . . 0.0 109.546 176.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.8 tp -59.37 -52.94 63.47 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.958 -0.464 . . . . 0.0 110.683 -173.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.259 1.1 pt? -71.37 -34.12 70.15 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.679 -175.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 mp -67.14 -42.25 84.73 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.214 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -58.99 -48.51 81.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.228 0.922 . . . . 0.0 111.265 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 m -63.72 -56.38 16.1 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.066 0.46 . . . . 0.0 110.844 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.42 -34.64 18.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.584 1.154 . . . . 0.0 112.495 -168.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 124.16 0.984 . . . . 0.0 111.374 -171.008 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.4 tp . . . . . 0 CA--C 1.517 -0.323 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -51.07 70.77 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.22 -54.46 29.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.7 tp -50.3 -55.61 14.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.486 0.715 . . . . 0.0 109.79 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -53.03 -51.46 61.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.109 0.564 . . . . 0.0 110.331 177.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -57.51 -38.57 74.86 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.434 0.561 . . . . 0.0 112.162 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.19 -33.78 72.15 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.237 0.615 . . . . 0.0 110.195 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -80.39 -56.13 4.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.628 1.171 . . . . 0.0 110.824 -173.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.02 40.87 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.462 1.505 . . . . 0.0 114.816 -166.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -170.625 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.679 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -138.62 134.08 33.28 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.115 0.957 . . . . 0.0 110.579 -175.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.6 t -87.96 119.49 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 124.097 0.959 . . . . 0.0 109.651 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 84.3 p -82.56 158.03 23.27 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.914 0.886 . . . . 0.0 111.132 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -55.61 -37.61 68.37 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.127 0.489 . . . . 0.0 110.801 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -56.59 -47.47 79.5 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.833 1.253 . . . . 0.0 109.973 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.8 -36.98 76.13 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.385 0.612 . . . . 0.0 109.61 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -56.27 -37.52 69.93 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.797 -0.564 . . . . 0.0 110.74 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -55.77 -35.96 66.81 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.645 -1.284 . . . . 0.0 111.896 171.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.56 -48.76 83.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.77 -40.76 30.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.417 0.687 . . . . 0.0 111.583 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.3 t . . . . . 0 N--CA 1.468 0.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.93 175.893 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 117.877 -1.059 . . . . 0.0 113.187 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.45 -47.11 25.95 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.043 1.829 . . . . 0.0 112.552 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.7 -46.14 73.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.365 0.666 . . . . 0.0 109.844 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -55.24 -50.98 68.07 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 109.544 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.92 -37.49 86.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.94 0.896 . . . . 0.0 110.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -57.03 -50.31 73.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.863 0.756 . . . . 0.0 110.353 170.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.17 -55.39 28.5 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 178.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.1 mt -50.93 -58.87 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -46.39 -57.68 4.43 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.988 1.315 . . . . 0.0 111.026 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.39 -37.88 88.3 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.267 0.485 . . . . 0.0 111.071 -175.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -61.79 -43.79 98.15 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.74 -0.6 . . . . 0.0 111.022 177.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -60.02 -58.25 9.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.018 -0.426 . . . . 0.0 111.199 171.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.07 -53.53 4.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.214 1.006 . . . . 0.0 111.492 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 178.525 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.1 mt -114.62 112.54 23.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.527 1.131 . . . . 0.0 111.58 -175.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.1 p -62.05 165.08 5.93 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.989 -1.069 . . . . 0.0 110.112 168.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -40.67 -46.74 2.66 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 123.915 0.886 . . . . 0.0 111.705 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.61 -52.44 65.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.496 0.318 . . . . 0.0 110.242 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -65.87 -39.75 90.99 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.035 0.445 . . . . 0.0 110.082 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.26 -49.14 78.29 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.81 1.644 . . . . 0.0 109.261 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -58.82 -46.85 86.69 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.386 -0.821 . . . . 0.0 110.315 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.8 tp -52.54 -58.64 6.12 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.41 -0.806 . . . . 0.0 111.824 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.279 1.2 pt? -69.97 -34.74 73.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 119.246 -0.982 . . . . 0.0 112.099 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.3 -42.06 99.0 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 119.535 1.062 . . . . 0.0 110.542 175.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -57.21 -52.91 63.43 Favored 'General case' 0 CA--C 1.527 0.064 0 CA-C-N 119.232 0.924 . . . . 0.0 110.924 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.9 m -62.32 -52.22 64.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.722 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -89.11 -34.96 16.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.07 0.948 . . . . 0.0 112.89 -168.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -168.807 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 tp . . . . . 0 C--O 1.222 -0.345 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -54.16 -51.94 62.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 122.17 0.188 . . . . 0.0 110.955 177.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -64.05 -53.56 47.93 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.328 0.651 . . . . 0.0 110.097 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.9 tp -50.05 -57.44 7.6 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.602 0.761 . . . . 0.0 109.119 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -54.1 -46.26 72.06 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.856 0.863 . . . . 0.0 111.403 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.92 -44.48 86.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.808 0.731 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -72.45 -46.01 56.92 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.868 0.366 . . . . 0.0 110.179 -176.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.06 -59.56 4.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.379 1.472 . . . . 0.0 109.048 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -80.37 47.53 0.93 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.93 1.692 . . . . 0.0 110.556 -173.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ttmm . . . . . 0 CA--C 1.533 0.314 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -167.735 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.683 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -132.39 137.94 47.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.455 1.102 . . . . 0.0 108.582 172.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.1 t -88.22 114.7 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 126.02 1.728 . . . . 0.0 108.569 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.7 p -76.47 159.57 30.29 Favored 'General case' 0 C--N 1.335 -0.047 0 C-N-CA 123.741 0.816 . . . . 0.0 110.53 172.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -55.33 -34.79 64.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.499 0.666 . . . . 0.0 111.174 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.88 -49.44 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.093 0.957 . . . . 0.0 110.393 174.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.65 -40.27 69.8 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -55.22 -41.85 72.58 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 121.796 -0.565 . . . . 0.0 110.601 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -57.59 -31.72 66.47 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.482 -0.761 . . . . 0.0 112.365 176.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.58 -28.84 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.558 -0.714 . . . . 0.0 110.932 171.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -74.08 -45.46 49.1 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.202 -0.936 . . . . 0.0 108.608 169.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 N--CA 1.465 0.287 0 O-C-N 121.267 -0.896 . . . . 0.0 111.76 -178.927 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.387 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.85 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.82 -44.37 31.95 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.266 1.977 . . . . 0.0 112.711 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -71.67 -42.25 67.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.896 0.478 . . . . 0.0 110.312 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.29 -52.08 65.84 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.142 0.496 . . . . 0.0 109.86 174.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.4 mt -64.14 -37.9 89.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.522 0.729 . . . . 0.0 109.826 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -55.88 -52.59 63.56 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 118.292 0.497 . . . . 0.0 110.047 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.01 -55.68 20.12 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.25 -54.75 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -46.25 -54.81 8.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.793 1.237 . . . . 0.0 109.626 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.59 -44.93 93.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.467 0.707 . . . . 0.0 110.824 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -61.25 -45.22 95.42 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 117.957 0.344 . . . . 0.0 111.375 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -60.79 -60.51 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.013 -0.429 . . . . 0.0 111.084 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.35 -49.78 6.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.037 1.735 . . . . 0.0 112.758 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 123.956 0.903 . . . . 0.0 113.396 176.753 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.86 152.76 23.47 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 125.889 1.676 . . . . 0.0 107.047 172.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.8 p -94.45 174.07 7.31 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -53.21 -38.93 63.32 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 119.649 1.113 . . . . 0.0 112.337 167.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.7 -51.88 63.07 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -62.64 -40.42 96.95 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.267 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.84 -49.86 75.79 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.132 0.573 . . . . 0.0 109.476 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -53.89 -51.04 64.98 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.621 -0.674 . . . . 0.0 109.978 175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -51.16 -62.23 1.74 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.416 0.686 . . . . 0.0 111.676 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.0 OUTLIER -70.79 -30.64 67.16 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.876 -176.156 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.28 -42.99 96.15 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 120.398 1.453 . . . . 0.0 109.63 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -58.32 -50.54 73.25 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.856 0.753 . . . . 0.0 110.838 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 m -61.15 -56.03 25.48 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.044 0.449 . . . . 0.0 110.719 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -87.13 -40.7 14.39 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.089 1.356 . . . . 0.0 112.078 -169.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 123.872 0.869 . . . . 0.0 111.033 -170.005 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.2 tp . . . . . 0 C--O 1.22 -0.458 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.75 -53.01 60.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.672 0.669 . . . . 0.0 110.495 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -62.5 -58.25 8.28 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.8 mp -53.36 -52.7 58.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.457 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 7.6 t80 -57.43 -45.85 84.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.703 0.401 . . . . 0.0 110.641 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -58.28 -41.68 84.9 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.062 0.392 . . . . 0.0 111.336 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -69.89 -44.12 70.4 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.526 0.679 . . . . 0.0 109.768 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.55 -52.22 23.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.272 1.429 . . . . 0.0 110.851 -172.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -75.87 74.4 2.8 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.063 0.945 . . . . 0.0 109.691 -172.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 124.34 1.056 . . . . 0.0 111.788 174.584 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.166 0 N-CA-C 111.918 -0.473 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -134.3 168.89 18.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.026 1.33 . . . . 0.0 109.285 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 67.5 t -139.55 109.39 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.05 1.34 . . . . 0.0 107.52 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.7 m -80.71 161.02 24.78 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 122.825 0.45 . . . . 0.0 111.098 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -51.55 -38.97 56.84 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-O 121.423 0.63 . . . . 0.0 110.753 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.09 -38.3 90.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.057 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.27 -45.35 63.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.4 -40.51 62.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.894 0.478 . . . . 0.0 110.966 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -55.52 -30.78 61.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.983 0.513 . . . . 0.0 111.882 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.4 t -61.7 -41.01 88.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 121.371 -0.831 . . . . 0.0 109.645 172.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -48.46 81.61 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 172.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 68.0 t . . . . . 0 CA--C 1.535 0.379 0 O-C-N 121.724 -0.61 . . . . 0.0 111.485 179.465 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.47 -54.3 5.29 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.03 1.82 . . . . 0.0 112.604 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -74.26 -35.96 63.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.387 0.275 . . . . 0.0 111.71 -177.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.97 -56.56 20.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.558 0.694 . . . . 0.0 109.303 176.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.64 -31.31 70.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.298 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.79 -50.24 71.01 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.706 1.139 . . . . 0.0 110.381 169.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.39 -55.41 22.35 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.599 -1.0 . . . . 0.0 110.599 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.5 mt -54.43 -59.12 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -42.32 -54.71 3.65 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.784 1.234 . . . . 0.0 110.539 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.53 -45.04 92.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.707 0.803 . . . . 0.0 110.062 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -59.9 -45.47 92.45 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 122.32 -0.238 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.02 -58.85 6.7 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.15 0.432 . . . . 0.0 111.329 173.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -46.84 7.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.398 1.479 . . . . 0.0 112.748 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.418 0 C-N-CA 124.668 1.187 . . . . 0.0 113.681 176.963 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.2 mt -110.24 110.32 21.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.917 0.887 . . . . 0.0 109.202 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.6 p -69.33 163.54 24.89 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 169.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -39.16 -46.09 1.41 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.202 1.001 . . . . 0.0 113.343 177.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -74.38 -32.63 62.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.191 0.451 . . . . 0.0 112.077 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -69.23 -45.58 69.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.93 -46.22 82.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.264 1.425 . . . . 0.0 109.434 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -57.38 -53.3 59.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 121.585 -0.697 . . . . 0.0 109.75 173.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -54.28 -53.37 54.61 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.878 0.471 . . . . 0.0 111.171 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.285 1.2 pt? -70.89 -35.17 72.21 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 118.903 -1.119 . . . . 0.0 112.081 -176.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.63 -36.59 84.13 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 119.591 1.087 . . . . 0.0 110.185 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -51.85 67.28 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.765 0.711 . . . . 0.0 109.808 173.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -63.75 -56.23 17.15 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 110.032 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -83.56 -36.99 23.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.239 1.016 . . . . 0.0 111.842 -169.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -169.764 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.9 tp . . . . . 0 C--O 1.224 -0.24 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -54.01 -55.75 24.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.205 0.202 . . . . 0.0 110.861 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.63 -47.99 68.03 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -173.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 77.3 mt -50.91 -61.95 1.9 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -55.22 -44.37 75.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.323 0.51 . . . . 0.0 111.267 -178.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -56.64 -43.8 80.67 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.348 0.259 . . . . 0.0 111.085 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -72.21 -43.37 64.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.465 0.65 . . . . 0.0 109.863 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.73 -51.53 54.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.985 1.714 . . . . 0.0 110.562 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -77.3 71.87 3.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 109.673 -172.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 125.573 1.549 . . . . 0.0 111.956 178.515 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -147.95 160.67 42.57 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.47 1.908 . . . . 0.0 107.315 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 42.4 t -116.43 115.39 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 125.54 1.536 . . . . 0.0 108.098 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.8 p -73.6 166.61 22.95 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.392 1.077 . . . . 0.0 110.622 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -53.2 -43.65 67.35 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.115 0.483 . . . . 0.0 110.156 171.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -64.16 -46.82 82.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 122.932 0.493 . . . . 0.0 109.724 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.94 -47.01 88.39 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.25 0.548 . . . . 0.0 109.652 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -54.1 -39.89 66.8 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.857 0.863 . . . . 0.0 111.181 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -56.2 -27.34 54.28 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.422 -0.799 . . . . 0.0 111.902 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.85 -46.86 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 119.102 0.865 . . . . 0.0 109.189 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -40.53 69.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.417 0.687 . . . . 0.0 109.856 174.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.4 t . . . . . 0 CA--C 1.543 0.691 0 O-C-N 121.378 -0.826 . . . . 0.0 112.173 174.747 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 117.665 -1.159 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -40.58 -45.57 4.57 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.032 2.488 . . . . 0.0 114.622 170.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -72.4 -42.5 65.08 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.886 0.766 . . . . 0.0 110.297 -176.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -57.08 -51.73 68.11 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.71 -41.28 90.46 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.088 0.955 . . . . 0.0 110.268 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.72 -51.36 69.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.334 0.516 . . . . 0.0 110.046 173.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.54 -56.75 18.45 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 177.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.89 -58.63 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 123.952 0.901 . . . . 0.0 109.289 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -47.57 -55.55 9.0 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.479 1.512 . . . . 0.0 110.402 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.65 -45.71 88.73 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.132 0.573 . . . . 0.0 111.618 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -58.92 -49.17 78.83 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.131 -0.355 . . . . 0.0 110.827 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -58.29 -56.45 21.97 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.013 -0.43 . . . . 0.0 111.197 174.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.02 -51.68 7.63 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.704 1.202 . . . . 0.0 112.48 177.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.455 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 177.486 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 119.643 -0.218 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.6 mt -120.39 129.9 54.13 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.83 1.252 . . . . 0.0 107.911 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 t -93.55 168.07 11.27 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 167.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -48.14 -34.62 10.18 Favored 'General case' 0 N--CA 1.461 0.125 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -170.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -70.5 -40.63 73.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.959 -0.463 . . . . 0.0 110.742 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.4 -42.42 75.12 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.51 -48.56 80.44 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 122.435 0.294 . . . . 0.0 110.987 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -62.69 -42.43 99.63 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 118.031 -1.468 . . . . 0.0 109.207 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.1 tp -54.49 -59.17 5.05 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.99 -0.444 . . . . 0.0 111.192 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.254 1.3 pt? -70.28 -35.33 73.65 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 119.032 -1.067 . . . . 0.0 112.245 -174.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -42.51 98.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 119.414 1.006 . . . . 0.0 110.119 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.22 -48.48 81.55 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.275 0.943 . . . . 0.0 111.11 173.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -61.19 -55.95 26.28 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.043 0.449 . . . . 0.0 110.562 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -87.1 -38.68 16.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.451 1.1 . . . . 0.0 112.069 -169.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 CA--C 1.535 0.37 0 C-N-CA 124.118 0.967 . . . . 0.0 111.758 -170.878 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.0 tp . . . . . 0 C--O 1.222 -0.382 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.74 -51.91 67.05 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.28 0.491 . . . . 0.0 110.014 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -66.9 -49.48 65.45 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.777 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.1 tp -54.51 -53.28 56.46 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -54.92 -47.89 73.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.486 0.714 . . . . 0.0 110.624 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -58.4 -40.44 82.42 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.168 0.44 . . . . 0.0 111.305 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.23 -47.8 63.73 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 121.668 0.747 . . . . 0.0 109.33 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -64.57 -57.45 9.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.609 1.563 . . . . 0.0 110.537 -174.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -74.34 75.18 1.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 tttp . . . . . 0 CA--C 1.537 0.447 0 C-N-CA 124.651 1.18 . . . . 0.0 111.504 178.489 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.145 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -142.22 160.76 39.6 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.182 0.993 . . . . 0.0 110.102 -176.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.46 103.95 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 76.5 p -68.15 173.6 4.56 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.355 0.662 . . . . 0.0 109.454 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -58.36 -35.87 72.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.737 0.78 . . . . 0.0 110.343 171.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -62.54 -51.69 66.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.857 0.863 . . . . 0.0 109.727 178.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.95 -46.29 88.38 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.02 -41.5 71.4 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.51 -0.744 . . . . 0.0 111.559 -177.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -56.54 -27.81 58.53 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.455 -0.778 . . . . 0.0 112.584 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.53 -35.98 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 119.432 1.015 . . . . 0.0 110.484 170.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.88 -48.76 73.1 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 171.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 63.8 t . . . . . 0 CA--C 1.532 0.277 0 O-C-N 122.112 -0.368 . . . . 0.0 111.03 178.461 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.72 -46.68 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.098 1.866 . . . . 0.0 112.109 175.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -68.85 -41.96 77.77 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.307 0.643 . . . . 0.0 110.064 -177.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.22 -52.11 65.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.03 -34.08 76.93 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 119.405 -0.331 . . . . 0.0 110.405 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -59.14 -51.06 71.66 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.708 0.685 . . . . 0.0 110.57 169.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.75 -54.19 34.72 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.4 mt -44.61 -64.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 125.084 1.354 . . . . 0.0 109.651 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -45.25 -53.96 7.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.74 0.816 . . . . 0.0 110.443 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.16 -49.95 74.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.934 0.894 . . . . 0.0 111.863 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.16 -45.57 92.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.529 1.058 . . . . 0.0 110.944 -179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -58.74 -53.55 57.11 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.88 -0.513 . . . . 0.0 110.759 177.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -53.93 19.32 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.889 1.276 . . . . 0.0 111.463 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.313 0 O-C-N 121.406 -0.808 . . . . 0.0 112.105 172.654 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.1 mt -106.65 127.76 53.62 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 125.62 1.568 . . . . 0.0 109.535 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.2 p -71.92 171.4 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.287 -0.883 . . . . 0.0 109.044 168.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 8.4 mtmp? -45.86 -44.61 14.49 Favored 'General case' 0 C--O 1.226 -0.173 0 O-C-N 121.637 -0.664 . . . . 0.0 110.969 167.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mp0 -68.39 -47.69 66.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.746 0.418 . . . . 0.0 109.936 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -61.62 -41.74 97.9 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.48 -48.77 80.38 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.702 1.201 . . . . 0.0 109.851 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -59.87 -48.9 79.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.228 -0.92 . . . . 0.0 110.093 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.4 tp -50.98 -60.86 2.64 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.88 0.872 . . . . 0.0 111.244 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 1.1 pt? -69.18 -31.67 70.45 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 119.063 -1.055 . . . . 0.0 112.199 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -65.92 -43.55 87.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 119.994 1.27 . . . . 0.0 110.55 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -55.84 -54.02 49.59 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.013 0.824 . . . . 0.0 110.677 171.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.0 m -65.67 -52.71 49.52 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.564 0.221 . . . . 0.0 111.289 -169.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -80.56 -39.05 28.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.634 0.773 . . . . 0.0 111.346 -175.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.364 -169.803 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp . . . . . 0 C--O 1.223 -0.321 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -52.84 -57.2 11.0 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.087 0.47 . . . . 0.0 109.92 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.49 -52.26 64.19 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.336 0.655 . . . . 0.0 110.114 -175.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.18 -54.5 35.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.755 0.822 . . . . 0.0 109.141 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 38.5 t80 -57.79 -45.3 86.23 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.038 0.535 . . . . 0.0 111.337 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.91 -42.94 95.01 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.144 0.884 . . . . 0.0 111.105 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.19 -50.52 67.77 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.807 0.813 . . . . 0.0 109.266 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -60.08 4.4 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 126.328 1.851 . . . . 0.0 109.715 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -80.35 49.82 1.19 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.908 1.683 . . . . 0.0 112.407 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? . . . . . 0 CA--C 1.534 0.355 0 CA-C-O 121.315 0.579 . . . . 0.0 109.797 -177.798 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.951 0 CA-C-O 119.695 -0.503 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -143.64 131.68 21.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.985 0.914 . . . . 0.0 110.411 -177.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 37.9 t -87.43 113.77 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 C-N-CA 127.303 2.241 . . . . 0.0 108.349 -171.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 96.7 p -79.72 165.68 22.57 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.095 0.558 . . . . 0.0 110.359 173.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -55.42 -33.94 63.98 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.917 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.96 -54.82 29.36 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.413 0.685 . . . . 0.0 110.226 173.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -69.11 -38.63 79.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -58.44 -39.51 80.03 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 121.763 -0.586 . . . . 0.0 110.778 179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -57.62 -35.17 70.12 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.464 1.484 . . . . 0.0 111.967 174.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.98 -39.57 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 121.205 -0.935 . . . . 0.0 109.3 171.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.39 -43.85 88.69 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 169.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.7 t . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 119.587 1.085 . . . . 0.0 110.731 178.556 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.456 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.62 -40.79 30.68 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.54 2.16 . . . . 0.0 113.294 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -71.1 -46.19 62.22 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.115 0.566 . . . . 0.0 109.994 -176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -58.37 -50.78 72.42 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.38 -40.81 95.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.997 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -56.96 -50.88 71.29 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 118.556 0.616 . . . . 0.0 110.527 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.67 -54.47 32.78 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 57.1 mt -50.01 -64.36 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 123.93 0.892 . . . . 0.0 109.352 175.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -45.73 -52.19 11.39 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.18 1.392 . . . . 0.0 110.239 -178.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.82 -45.96 91.56 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.626 1.171 . . . . 0.0 110.457 -175.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.29 -49.04 79.19 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.252 -0.28 . . . . 0.0 110.557 178.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -56.28 -60.54 3.36 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 117.972 0.351 . . . . 0.0 111.388 175.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.28 -55.12 3.46 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.923 1.689 . . . . 0.0 111.914 177.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 CA--C 1.539 0.542 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.4 mt -119.99 135.19 55.01 Favored 'General case' 0 C--N 1.345 0.402 0 C-N-CA 125.658 1.583 . . . . 0.0 109.575 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.9 p -74.13 172.67 11.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.105 0.866 . . . . 0.0 109.181 168.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.406 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -55.33 -38.42 68.71 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.041 -1.037 . . . . 0.0 112.152 168.306 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.31 -52.41 64.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.84 -40.78 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.55 -47.31 86.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.368 1.067 . . . . 0.0 110.027 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -57.24 -51.44 69.36 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.664 -0.815 . . . . 0.0 109.536 172.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.1 tp -52.6 -55.86 19.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.629 0.372 . . . . 0.0 111.773 -173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.26 1.3 pt? -69.85 -35.55 74.82 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 119.143 -1.023 . . . . 0.0 112.249 -177.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -64.77 -40.4 95.2 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 120.562 1.528 . . . . 0.0 109.936 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.34 -52.18 65.53 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.007 0.523 . . . . 0.0 111.003 171.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.55 -49.6 58.24 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 -172.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -86.47 -37.5 18.21 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.173 0.989 . . . . 0.0 111.589 -169.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 . . . . . 0 CA--C 1.539 0.55 0 C-N-CA 124.22 1.008 . . . . 0.0 111.649 -175.145 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.223 -0.305 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.48 -55.39 32.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -60.82 -53.74 53.71 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.069 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.48 -54.57 39.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.793 0.837 . . . . 0.0 109.183 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.406 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 41.2 t80 -57.51 -45.42 84.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.515 0.726 . . . . 0.0 111.196 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -61.18 -45.03 96.29 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 118.799 0.727 . . . . 0.0 110.89 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.13 -47.07 84.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.559 0.695 . . . . 0.0 109.346 -176.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -61.2 2.52 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.887 1.675 . . . . 0.0 109.77 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -80.58 54.99 2.2 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.476 1.51 . . . . 0.0 111.75 -168.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 mttp . . . . . 0 C--N 1.33 -0.239 0 C-N-CA 123.214 0.605 . . . . 0.0 111.396 -174.86 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.759 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -138.76 128.93 25.52 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.561 1.144 . . . . 0.0 109.691 179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 66.3 t -87.37 99.8 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 -178.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.3 m -68.53 155.52 39.79 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -46.5 -36.99 7.25 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.542 0.686 . . . . 0.0 112.178 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -60.62 -41.19 94.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.718 0.807 . . . . 0.0 110.927 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -72.34 -40.84 67.09 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 174.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.4 -42.63 64.19 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.708 -0.62 . . . . 0.0 110.961 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -39.74 20.09 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.667 -0.645 . . . . 0.0 112.494 172.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.1 t -61.42 -39.84 84.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 O-C-N 121.746 -0.596 . . . . 0.0 110.149 175.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.44 -51.63 69.07 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t . . . . . 0 CA--C 1.533 0.292 0 CA-C-N 117.929 0.331 . . . . 0.0 111.057 -176.461 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 117.695 -1.145 . . . . 0.0 112.403 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -50.75 11.14 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.367 2.045 . . . . 0.0 112.315 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.64 -48.04 82.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.192 0.597 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.04 -50.17 71.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.764 0.426 . . . . 0.0 109.852 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.65 -38.7 92.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.108 0.963 . . . . 0.0 109.593 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -59.56 -52.37 65.83 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.271 0.487 . . . . 0.0 110.387 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.51 -54.22 36.06 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.8 mt -45.19 -64.32 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.558 1.143 . . . . 0.0 109.497 172.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -48.21 -56.13 8.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.463 1.505 . . . . 0.0 110.534 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -56.91 -47.02 81.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.56 0.344 . . . . 0.0 110.889 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -60.51 -44.17 96.29 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.984 -0.448 . . . . 0.0 111.113 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -59.66 -57.28 13.62 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 118.161 0.437 . . . . 0.0 111.132 174.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -50.52 13.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.776 0.83 . . . . 0.0 111.633 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.707 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 119.712 -0.185 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.7 mt -100.67 118.98 37.9 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.026 0.93 . . . . 0.0 110.459 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.6 m -68.68 157.33 36.48 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 166.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -40.71 2.38 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 173.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.6 -53.48 54.07 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.646 0.378 . . . . 0.0 111.294 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.77 -44.9 94.97 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.76 -47.72 81.69 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.294 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.14 -58.45 7.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.069 173.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.7 tp -49.52 -55.4 13.5 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 123.337 0.398 . . . . 0.0 111.661 -173.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.271 0.7 OUTLIER -72.21 -32.36 66.7 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.719 -174.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.06 -42.85 93.83 Favored 'General case' 0 CA--C 1.523 -0.079 0 CA-C-N 120.065 1.302 . . . . 0.0 109.943 174.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.28 -47.57 81.76 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.954 -0.699 . . . . 0.0 109.928 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.3 m -69.15 -50.5 47.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.606 -173.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -87.59 -38.2 16.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.562 -169.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 . . . . . 0 CA--C 1.541 0.632 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -167.482 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 tp . . . . . 0 C--O 1.224 -0.254 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.79 -52.03 65.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.98 -57.0 14.45 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.45 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.22 -53.49 49.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.955 0.502 . . . . 0.0 110.047 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.52 -48.06 75.27 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.303 178.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.49 -42.25 95.94 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.106 0.412 . . . . 0.0 111.321 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.0 -48.19 59.14 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.553 0.692 . . . . 0.0 109.624 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.45 -57.27 10.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.379 1.472 . . . . 0.0 109.557 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -80.33 44.88 0.72 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.73 1.212 . . . . 0.0 112.475 -168.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? . . . . . 0 CA--C 1.531 0.224 0 C-N-CA 124.071 0.949 . . . . 0.0 111.211 -172.132 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.854 0 CA-C-O 119.496 -0.613 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -136.99 127.71 27.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.236 1.014 . . . . 0.0 109.173 -172.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.2 t -88.69 110.88 21.83 Favored 'Isoleucine or valine' 0 C--N 1.339 0.14 0 C-N-CA 123.903 0.881 . . . . 0.0 108.653 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.7 p -74.32 166.21 23.86 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.941 0.897 . . . . 0.0 110.242 171.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -56.81 -35.86 69.24 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.453 0.644 . . . . 0.0 110.173 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -61.18 -49.48 77.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.083 0.953 . . . . 0.0 110.179 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.33 -44.22 92.2 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.69 176.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -52.69 -40.9 63.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.665 0.786 . . . . 0.0 110.547 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -35.91 46.8 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.102 0.561 . . . . 0.0 112.173 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.16 -38.31 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 118.698 0.681 . . . . 0.0 110.227 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.63 -45.68 74.67 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 CA--C 1.534 0.354 0 O-C-N 121.646 -0.659 . . . . 0.0 111.393 177.892 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 117.858 -1.067 . . . . 0.0 112.298 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -47.5 -50.4 11.46 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.319 2.013 . . . . 0.0 112.449 177.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.98 -47.65 83.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.251 0.62 . . . . 0.0 110.826 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -56.41 -50.22 72.24 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.686 0.395 . . . . 0.0 110.094 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.14 -37.2 83.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.058 0.943 . . . . 0.0 109.853 -176.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -58.53 -54.12 50.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.831 0.452 . . . . 0.0 109.805 171.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.17 25.61 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -45.81 -62.81 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.401 1.48 . . . . 0.0 109.818 173.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -45.25 -57.51 3.93 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.49 1.116 . . . . 0.0 110.151 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.09 -48.15 79.3 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.238 -0.411 . . . . 0.0 112.086 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -62.81 -45.93 90.33 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.751 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -56.98 -53.31 59.45 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.732 0.696 . . . . 0.0 111.285 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -46.46 -59.47 2.95 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.319 1.048 . . . . 0.0 110.429 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.233 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.873 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.531 0.245 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.5 mt -96.7 109.34 22.0 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.753 0.821 . . . . 0.0 110.321 -175.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -59.07 164.26 3.12 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.179 0.9 . . . . 0.0 109.316 168.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -48.21 -33.83 9.2 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 169.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -63.23 -51.91 64.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.333 0.515 . . . . 0.0 109.616 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -57.9 -50.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.2 -45.67 87.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.065 -172.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -58.3 -56.07 26.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.775 -0.578 . . . . 0.0 109.854 171.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -52.4 -53.22 47.92 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.891 0.476 . . . . 0.0 111.523 -172.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.252 0.9 OUTLIER -73.14 -31.73 64.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.523 -176.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp -66.39 -42.05 88.48 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 120.886 1.675 . . . . 0.0 109.157 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -51.03 70.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 122.512 0.325 . . . . 0.0 111.643 172.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -70.66 -50.97 31.09 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 118.453 0.569 . . . . 0.0 110.144 -173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -83.77 -37.61 22.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.841 0.856 . . . . 0.0 111.024 -169.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 . . . . . 0 C--O 1.235 0.293 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.861 -172.818 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 23.6 tp . . . . . 0 C--O 1.224 -0.27 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.15 -53.08 60.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.323 0.51 . . . . 0.0 110.02 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -66.1 -49.43 67.57 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.959 0.504 . . . . 0.0 109.732 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -54.27 -56.0 22.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -56.43 -46.29 80.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.724 0.809 . . . . 0.0 111.072 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -58.91 -41.45 87.29 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.149 0.431 . . . . 0.0 111.18 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -65.46 -43.36 90.58 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -73.48 -53.73 9.91 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.455 1.502 . . . . 0.0 111.555 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -81.02 51.95 1.67 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.899 1.28 . . . . 0.0 113.784 -167.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? . . . . . 0 N--CA 1.466 0.363 0 C-N-CA 126.195 1.798 . . . . 0.0 113.301 -172.305 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.633 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -145.62 137.93 25.63 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.093 0.557 . . . . 0.0 111.113 169.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 41.6 t -89.09 119.12 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 C-N-CA 126.635 1.974 . . . . 0.0 109.796 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.2 m -73.49 153.56 40.28 Favored 'General case' 0 C--O 1.228 -0.077 0 C-N-CA 124.967 1.307 . . . . 0.0 109.92 172.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -50.26 -39.96 46.59 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.158 0.504 . . . . 0.0 111.408 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -63.28 -36.41 83.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.399 0.68 . . . . 0.0 110.934 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.32 -44.34 52.92 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -52.42 -40.75 62.54 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 123.256 0.622 . . . . 0.0 110.313 175.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -54.82 -33.59 61.79 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.579 -0.701 . . . . 0.0 111.851 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.71 -42.8 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.375 -0.828 . . . . 0.0 109.322 173.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.46 -47.17 84.92 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 170.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.3 t . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 119.362 0.983 . . . . 0.0 111.68 179.889 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 117.411 -1.28 . . . . 0.0 113.701 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.56 -49.88 12.51 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.079 1.853 . . . . 0.0 112.944 176.109 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -75.54 -38.82 59.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.783 0.433 . . . . 0.0 110.559 -175.642 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -57.03 -53.21 60.67 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.62 0.724 . . . . 0.0 109.222 175.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.1 mt -61.49 -38.49 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.01 0.924 . . . . 0.0 109.739 178.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -57.98 -45.97 85.9 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 119.188 0.903 . . . . 0.0 111.229 172.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.01 -54.43 36.98 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 176.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.5 mt -51.91 -61.14 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 123.49 0.716 . . . . 0.0 109.452 178.026 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -43.42 -58.58 2.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.231 1.812 . . . . 0.0 109.981 177.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -55.94 -46.97 78.37 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.78 0.832 . . . . 0.0 111.292 -178.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -59.97 -47.48 85.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 119.32 -0.371 . . . . 0.0 111.203 179.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -61.76 -55.34 31.22 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.471 173.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.56 -51.55 2.93 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.354 1.862 . . . . 0.0 112.226 177.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 175.65 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 111.263 0.098 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -94.86 112.12 23.86 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.318 1.047 . . . . 0.0 110.039 -175.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.9 t -73.14 168.32 19.33 Favored 'General case' 0 C--O 1.23 0.051 0 C-N-CA 117.791 -1.563 . . . . 0.0 108.965 167.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -38.82 -45.39 1.15 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.716 1.606 . . . . 0.0 111.992 178.595 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.15 -46.32 84.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -62.2 -50.08 73.23 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.01 -50.52 73.76 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -175.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -51.64 -57.15 9.99 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 176.218 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -44.75 95.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -168.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.8 tt -56.26 -57.31 12.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 175.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.04 -41.3 78.42 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 121.079 -1.013 . . . . 0.0 112.043 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.19 -49.92 72.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.557 1.071 . . . . 0.0 109.121 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 26.3 m -69.96 -51.12 35.22 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.417 -171.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -81.63 -39.08 24.99 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.774 0.83 . . . . 0.0 110.994 -172.578 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 . . . . . 0 C--O 1.235 0.327 0 CA-C-N 118.593 0.633 . . . . 0.0 110.66 -170.262 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.5 tp . . . . . 0 C--O 1.222 -0.371 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -52.22 -54.84 26.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.01 0.368 . . . . 0.0 110.697 177.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -63.42 -50.01 71.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.497 0.719 . . . . 0.0 109.759 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 tp -55.63 -53.82 51.76 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.344 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -55.02 -46.25 75.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.914 0.485 . . . . 0.0 109.994 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.42 -45.71 80.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.202 0.455 . . . . 0.0 111.811 -179.183 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -77.01 -36.97 55.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 -176.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.08 -47.02 69.43 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.072 1.349 . . . . 0.0 110.182 -178.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.5 64.44 2.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.756 1.222 . . . . 0.0 110.719 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 125.043 1.337 . . . . 0.0 109.875 178.926 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.981 0 CA-C-O 119.767 -0.463 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -144.48 121.5 11.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.62 1.168 . . . . 0.0 109.195 178.133 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 115.85 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 125.145 1.378 . . . . 0.0 109.119 -176.204 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.7 p -73.74 163.05 28.49 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 124.109 0.964 . . . . 0.0 111.081 173.079 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.36 -41.03 68.67 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.64 0.376 . . . . 0.0 110.016 177.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -57.98 -51.33 70.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.716 0.806 . . . . 0.0 110.914 177.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.1 -44.76 96.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -52.11 -41.79 62.74 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.747 0.819 . . . . 0.0 111.317 177.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -52.79 -35.53 56.79 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.8 0.727 . . . . 0.0 112.009 176.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.0 t -57.62 -40.6 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 118.439 0.563 . . . . 0.0 110.104 175.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.0 tp -66.28 -45.65 79.73 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.824 -0.547 . . . . 0.0 109.624 172.292 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 CA--C 1.536 0.405 0 CA-C-N 118.347 0.521 . . . . 0.0 111.284 -178.032 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.437 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.07 -50.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.519 2.146 . . . . 0.0 112.376 176.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.25 -44.67 94.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.136 0.574 . . . . 0.0 110.981 -179.233 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -57.69 -51.15 70.71 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.107 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.7 mt -62.38 -42.17 99.21 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.336 0.654 . . . . 0.0 109.761 -178.072 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -55.01 -51.05 67.47 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.371 0.532 . . . . 0.0 110.766 171.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -55.68 26.11 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.46 -59.15 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 C-N-CA 123.907 0.883 . . . . 0.0 109.288 176.43 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -47.28 -55.18 9.19 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.911 1.284 . . . . 0.0 109.741 -179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -57.57 -47.45 82.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.59 0.756 . . . . 0.0 111.076 -176.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.83 -48.85 79.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.775 -178.465 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -57.04 -59.68 4.71 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.348 0.594 . . . . 0.0 111.064 174.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.9 -51.46 13.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.889 2.076 . . . . 0.0 112.154 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.234 0 C-N-CA 123.631 0.772 . . . . 0.0 112.401 177.014 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 . . . . . 0 CA--C 1.551 1.007 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.8 117.03 32.97 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.865 2.066 . . . . 0.0 111.412 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.3 m -65.49 159.49 24.31 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.022 1.283 . . . . 0.0 111.02 169.094 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 59.3 mtmt -37.99 -53.27 1.37 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.341 1.456 . . . . 0.0 112.867 177.263 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mp0 -65.71 -31.45 72.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 119.5 -0.286 . . . . 0.0 110.406 -175.821 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -73.77 -43.53 58.73 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.66 -45.96 77.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.566 0.746 . . . . 0.0 109.358 173.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -60.47 -49.05 79.09 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 121.407 -0.808 . . . . 0.0 110.685 173.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.99 -60.8 2.47 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 123.548 0.739 . . . . 0.0 111.164 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.251 1.4 pt? -70.94 -33.61 70.66 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.384 -172.123 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -65.43 -42.63 92.26 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.344 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -58.24 -50.34 73.92 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.919 1.236 . . . . 0.0 110.856 173.061 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -62.2 -56.71 15.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 110.498 -173.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -84.25 -35.48 23.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.336 1.054 . . . . 0.0 111.604 -170.0 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 123.84 0.856 . . . . 0.0 112.028 -169.881 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.5 tp . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -55.97 -51.15 68.72 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -178.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.53 -54.83 33.97 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.168 0.587 . . . . 0.0 109.731 -178.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.4 tp -51.43 -58.15 7.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 27.1 t80 -54.86 -43.98 73.57 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.23 1.012 . . . . 0.0 111.214 -179.204 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -57.59 -44.57 85.47 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.199 0.454 . . . . 0.0 111.048 179.537 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -72.02 -43.9 64.28 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 -179.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.04 -59.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.427 1.491 . . . . 0.0 110.253 -176.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -78.28 65.28 3.59 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -178.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.6 pttm . . . . . 0 CA--C 1.534 0.35 0 C-N-CA 123.324 0.65 . . . . 0.0 111.483 -179.641 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.894 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -164.92 134.38 3.62 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -173.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.8 t -88.58 103.73 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 126.623 1.969 . . . . 0.0 108.776 -168.085 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.61 152.82 37.81 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.634 1.174 . . . . 0.0 109.193 175.089 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -51.01 -33.79 26.46 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.74 0.7 . . . . 0.0 111.731 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -55.59 -53.13 60.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.189 0.996 . . . . 0.0 110.584 173.106 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -62.57 -43.28 99.2 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -58.43 -44.65 89.22 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 122.048 -0.407 . . . . 0.0 111.028 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -57.96 -37.48 74.26 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.193 -0.942 . . . . 0.0 111.635 176.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.53 -38.99 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.439 -0.788 . . . . 0.0 109.802 172.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -50.93 68.97 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.652 -0.655 . . . . 0.0 109.75 169.443 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 CA--C 1.53 0.198 0 C-N-CA 123.549 0.74 . . . . 0.0 110.801 -179.569 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.825 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.36 -43.93 46.46 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.356 2.038 . . . . 0.0 112.439 176.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.26 -43.75 73.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.189 0.596 . . . . 0.0 109.925 -177.682 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -56.73 -52.26 65.67 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.7 mt -60.48 -42.12 95.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.992 0.517 . . . . 0.0 109.87 -178.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -56.08 -51.51 67.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.293 0.497 . . . . 0.0 110.627 172.534 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.92 37.96 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -50.36 -60.9 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 123.63 0.772 . . . . 0.0 109.047 175.196 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.4 -57.11 4.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.07 1.348 . . . . 0.0 110.576 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.27 -47.86 77.76 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 111.765 179.676 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -59.08 -44.25 91.87 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.997 -0.439 . . . . 0.0 111.784 179.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -63.91 -56.26 16.62 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.808 0.731 . . . . 0.0 111.381 173.125 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.97 -46.25 2.77 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.229 1.812 . . . . 0.0 112.68 178.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 174.541 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.3 mt -111.5 123.01 49.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.15 1.38 . . . . 0.0 109.891 -175.099 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -84.44 168.96 15.03 Favored 'General case' 0 C--N 1.335 -0.058 0 CA-C-N 120.431 1.468 . . . . 0.0 109.476 168.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -38.48 -47.84 1.32 Allowed 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 126.152 1.781 . . . . 0.0 110.743 178.365 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -51.69 -55.44 19.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.296 0.638 . . . . 0.0 111.513 176.145 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -62.43 -44.77 95.64 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.26 -47.67 84.47 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.765 -0.159 . . . . 0.0 110.86 -173.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -55.36 -55.45 31.38 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 121.211 -0.931 . . . . 0.0 109.531 173.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 tp -51.84 -55.32 20.72 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.718 1.261 . . . . 0.0 110.416 -172.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 0.8 OUTLIER -75.35 -32.82 61.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 118.539 -0.743 . . . . 0.0 111.793 -175.487 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.16 -44.25 76.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 120.266 1.394 . . . . 0.0 110.854 178.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -51.59 68.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.109 174.6 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 51.5 m -66.3 -52.51 46.57 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 121.163 -0.215 . . . . 0.0 111.279 -171.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.581 0.752 . . . . 0.0 111.347 -170.772 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -169.492 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.24 -43.38 74.54 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.243 0.929 . . . . 0.0 110.422 178.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.95 -58.68 4.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.298 0.639 . . . . 0.0 109.472 175.157 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -50.15 -50.03 50.26 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.851 0.86 . . . . 0.0 110.628 -174.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -51.32 -39.8 57.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.847 1.659 . . . . 0.0 111.053 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -61.32 -35.26 76.91 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 117.908 0.322 . . . . 0.0 110.727 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.19 -44.94 18.92 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.17 -56.52 20.72 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.022 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -79.86 65.73 5.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.711 0.804 . . . . 0.0 109.87 -172.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? . . . . . 0 CA--C 1.536 0.426 0 C-N-CA 124.078 0.951 . . . . 0.0 112.018 176.7 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.44 0 N-CA-C 108.254 -1.939 . . . . 0.0 108.254 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -157.98 154.03 27.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 126.901 2.081 . . . . 0.0 107.745 -169.508 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.7 t -117.98 112.92 40.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 125.681 1.592 . . . . 0.0 108.037 -172.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.6 p -67.52 162.55 23.05 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 123.185 0.594 . . . . 0.0 110.611 175.556 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -54.34 -37.45 64.92 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.608 0.718 . . . . 0.0 110.478 169.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -59.46 -56.79 17.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.933 0.893 . . . . 0.0 110.084 177.542 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -59.93 -42.01 93.04 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.433 0.635 . . . . 0.0 110.046 179.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -54.74 -47.73 73.46 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 177.114 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.64 -28.27 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.602 -0.686 . . . . 0.0 112.408 178.09 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.4 t -64.24 -50.97 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 169.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.43 -39.18 69.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.175 -0.328 . . . . 0.0 111.539 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.0 t . . . . . 0 CA--C 1.536 0.427 0 C-N-CA 124.529 1.132 . . . . 0.0 111.825 175.252 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.13 -43.09 61.52 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.122 1.881 . . . . 0.0 112.231 174.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.85 -40.69 83.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.351 0.661 . . . . 0.0 109.669 -178.727 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.68 -53.02 61.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.526 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.19 -37.69 86.27 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.437 -178.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -56.42 -50.71 70.84 Favored 'General case' 0 CA--C 1.527 0.07 0 CA-C-N 118.681 0.673 . . . . 0.0 110.296 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.69 -52.85 45.65 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 178.418 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.8 mt -52.78 -60.1 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.721 0.808 . . . . 0.0 109.362 177.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -46.86 -54.35 10.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.699 1.2 . . . . 0.0 109.863 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.13 -51.36 69.6 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.158 0.983 . . . . 0.0 110.679 -178.109 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -58.33 -47.66 83.05 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.913 -0.492 . . . . 0.0 111.557 -179.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -54.0 -62.17 1.83 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.33 0.586 . . . . 0.0 110.967 171.468 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.54 -45.0 46.95 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.335 -174.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.323 0 C-N-CA 123.692 0.797 . . . . 0.0 112.486 177.74 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.537 0.444 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.1 mt -101.88 124.97 48.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.58 1.152 . . . . 0.0 111.111 -176.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 86.5 p -63.55 164.47 9.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.358 0.981 . . . . 0.0 108.982 167.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -52.32 -38.28 58.13 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.078 -1.014 . . . . 0.0 112.473 169.337 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.39 -49.92 74.95 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.371 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -63.15 -41.92 99.35 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 122.218 -0.302 . . . . 0.0 111.242 178.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.94 -43.61 94.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.33 1.052 . . . . 0.0 109.154 178.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -55.91 -58.53 7.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.27 -60.45 2.12 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.353 1.061 . . . . 0.0 111.561 -173.192 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -67.35 -33.12 74.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.775 -174.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.88 -37.43 86.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.073 174.142 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -63.21 -48.99 75.97 Favored 'General case' 0 CA--C 1.527 0.067 0 CA-C-N 120.206 1.366 . . . . 0.0 109.25 176.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -63.76 -55.57 22.14 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.037 -173.343 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -86.43 -36.08 19.31 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.995 0.918 . . . . 0.0 111.787 -169.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 123.756 0.822 . . . . 0.0 112.213 -169.233 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 tp . . . . . 0 C--O 1.224 -0.265 0 CA-C-O 119.588 -0.244 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -57.21 -54.05 51.14 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.057 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.7 -55.61 18.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.002 -177.21 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tt -49.65 -56.09 11.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.623 1.169 . . . . 0.0 109.678 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -58.45 -46.45 86.54 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.197 -0.43 . . . . 0.0 110.76 179.274 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -42.7 89.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.589 0.632 . . . . 0.0 111.316 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -70.12 -50.16 43.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.685 0.755 . . . . 0.0 109.611 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.45 -55.05 39.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.471 1.508 . . . . 0.0 109.603 -178.018 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -80.64 46.35 0.86 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.071 1.348 . . . . 0.0 112.245 -169.362 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 pttt . . . . . 0 CA--C 1.533 0.306 0 C-N-CA 126.68 1.992 . . . . 0.0 114.048 -171.394 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -138.99 127.01 22.38 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.499 1.119 . . . . 0.0 110.14 179.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 32.9 t -88.48 117.82 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 124.746 1.218 . . . . 0.0 110.345 -177.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.2 m -80.89 155.77 26.37 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.54 1.136 . . . . 0.0 110.849 172.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -55.54 -33.38 63.77 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.077 0.465 . . . . 0.0 112.091 -178.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.55 -47.5 69.96 Favored 'General case' 0 C--O 1.227 -0.092 0 O-C-N 121.592 -0.693 . . . . 0.0 110.714 172.26 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -72.79 -41.26 65.19 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -53.7 -43.92 69.37 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.981 -0.449 . . . . 0.0 110.494 177.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -57.4 -30.79 65.23 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.745 -0.597 . . . . 0.0 112.571 177.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.6 t -61.17 -39.83 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.245 0.93 . . . . 0.0 109.63 171.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -46.87 84.52 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.312 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.7 t . . . . . 0 CA--C 1.536 0.439 0 O-C-N 121.339 -0.851 . . . . 0.0 111.659 177.812 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.7 tptt . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.903 -0.036 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -51.46 59.48 Favored Pre-proline 0 N--CA 1.452 -0.335 0 CA-C-O 118.006 -0.997 . . . . 0.0 112.934 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.54 -48.04 22.11 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.975 1.783 . . . . 0.0 111.965 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.02 -47.65 76.7 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 123.328 0.651 . . . . 0.0 110.08 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -56.72 -50.19 72.94 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 mt -67.05 -37.01 83.29 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.225 0.61 . . . . 0.0 109.752 -175.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -60.32 -47.74 84.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.294 0.497 . . . . 0.0 110.525 172.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -56.18 -55.63 28.4 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -47.65 -63.92 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.657 1.183 . . . . 0.0 109.15 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -43.38 -55.73 3.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.503 1.521 . . . . 0.0 110.777 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.73 -48.59 79.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.956 0.903 . . . . 0.0 110.682 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -60.02 -47.4 86.0 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.048 -0.408 . . . . 0.0 111.009 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.36 -55.89 28.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.211 0.459 . . . . 0.0 110.977 174.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.88 -53.25 6.23 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.391 1.076 . . . . 0.0 112.013 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.8 -32.8 3.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -58.1 -33.68 69.36 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 111.161 177.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.12 18.57 3.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.334 1.054 . . . . 0.0 111.31 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.46 -61.79 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -178.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -55.34 111.05 2.63 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 124.017 0.927 . . . . 0.0 109.25 176.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.17 -13.88 28.55 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 122.104 1.869 . . . . 0.0 112.545 -173.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -121.4 22.42 10.75 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 118.493 -0.765 . . . . 0.0 112.967 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.35 140.99 16.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -174.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 mt -111.95 110.13 20.28 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.049 1.34 . . . . 0.0 111.01 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 m -62.84 159.96 15.55 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.411 -0.805 . . . . 0.0 109.42 167.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 1.2 mptp? -38.61 -50.56 1.61 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 124.305 1.042 . . . . 0.0 112.849 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.62 -41.15 98.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.469 0.176 . . . . 0.0 111.329 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -68.54 -44.79 73.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.88 -52.89 63.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -50.47 -56.27 12.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.153 0.581 . . . . 0.0 109.848 175.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -58.65 -45.91 88.27 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.867 1.267 . . . . 0.0 109.014 -169.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.2 tt -59.02 -55.45 34.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.79 -37.2 70.8 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.114 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.8 -51.85 66.59 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 119.285 0.948 . . . . 0.0 109.125 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -66.91 -51.76 51.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.416 -172.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -77.86 -40.56 39.74 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.541 0.737 . . . . 0.0 111.629 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -133.74 62.6 59.42 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 123.765 0.826 . . . . 0.0 112.859 -169.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -39.24 -36.24 0.82 Allowed 'Trans proline' 0 C--N 1.349 0.562 1 C-N-CA 125.894 4.396 . . . . 0.0 117.977 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 p -98.46 -19.62 17.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.572 1.549 . . . . 0.0 112.545 -173.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.8 -39.63 85.61 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.269 0.94 . . . . 0.0 110.539 -171.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.17 -21.4 63.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 175.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? 62.98 -65.8 0.1 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.576 1.95 . . . . 0.0 112.661 -175.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -151.65 133.49 4.22 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 108.01 -2.036 . . . . 0.0 108.01 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.5 mmt -34.38 -54.26 0.52 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.371 1.869 . . . . 0.0 114.185 -169.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -44.41 -40.26 5.31 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 113.106 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -52.6 -25.72 11.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.509 1.124 . . . . 0.0 111.747 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.4 tp -49.25 -38.91 28.39 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.538 0.735 . . . . 0.0 110.573 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -55.92 -55.39 33.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.174 0.511 . . . . 0.0 110.356 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.09 -50.72 63.09 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.11 -57.09 12.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.827 0.851 . . . . 0.0 109.162 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.6 t80 -59.69 -43.52 94.03 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 118.072 0.396 . . . . 0.0 110.558 -179.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.97 -43.7 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.12 0.418 . . . . 0.0 111.1 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.71 -53.57 13.09 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.39 0.614 . . . . 0.0 109.548 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.26 -59.71 4.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.103 2.161 . . . . 0.0 109.738 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -81.08 45.15 0.81 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.527 0.731 . . . . 0.0 112.401 -169.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -49.08 67.13 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.068 0.947 . . . . 0.0 111.688 -169.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.83 13.86 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.107 0.563 . . . . 0.0 111.231 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.61 -34.88 56.26 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.918 -169.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 66.43 -57.67 0.37 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.806 2.042 . . . . 0.0 113.849 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.21 -51.33 3.77 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 124.472 1.034 . . . . 0.0 111.635 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -127.21 139.27 53.05 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.388 1.475 . . . . 0.0 109.261 -172.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.93 111.02 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 124.943 1.297 . . . . 0.0 107.784 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -75.95 166.54 23.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -57.34 -32.22 66.51 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.32 0.581 . . . . 0.0 110.956 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -53.94 -55.49 26.57 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.866 0.866 . . . . 0.0 110.244 172.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -65.99 -41.27 91.3 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -56.01 -43.18 77.47 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.808 -0.557 . . . . 0.0 111.204 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -56.18 -30.21 61.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.531 -0.731 . . . . 0.0 112.039 176.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.8 -42.63 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.336 0.971 . . . . 0.0 110.283 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.65 -47.01 88.15 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.59 -42.94 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.546 -0.721 . . . . 0.0 111.499 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -57.5 -26.74 61.76 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.407 -0.808 . . . . 0.0 112.127 175.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -76.69 -53.12 8.41 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.931 0.787 . . . . 0.0 110.106 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -33.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 118.542 0.61 . . . . 0.0 111.656 -175.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.4 m 76.25 -44.16 0.48 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.595 1.958 . . . . 0.0 112.453 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? . . . . . 0 C--O 1.251 1.18 0 CA-C-O 117.413 -1.28 . . . . 0.0 110.479 174.709 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -53.91 -48.17 94.61 Favored Pre-proline 0 N--CA 1.451 -0.386 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.216 -175.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.87 -48.04 23.48 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.817 1.678 . . . . 0.0 111.976 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.5 mp0 -65.73 -46.6 78.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.487 0.715 . . . . 0.0 110.141 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -57.8 -49.0 78.11 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mp -67.84 -33.01 73.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.523 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.25 -50.29 74.25 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.093 0.86 . . . . 0.0 110.175 169.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.97 -56.96 18.3 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.504 -1.039 . . . . 0.0 110.504 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.9 mt -44.16 -64.98 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.783 1.633 . . . . 0.0 110.01 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -43.14 -54.34 4.49 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.687 1.195 . . . . 0.0 109.662 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -59.1 -53.51 57.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.904 0.882 . . . . 0.0 111.448 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -63.65 -33.2 75.11 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 119.935 -0.706 . . . . 0.0 112.033 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -65.79 -60.62 2.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.853 0.752 . . . . 0.0 110.972 170.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.9 -41.02 4.92 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 125.614 1.565 . . . . 0.0 112.747 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -42.62 -36.18 1.32 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 174.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -74.19 -27.43 60.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.113 0.869 . . . . 0.0 112.058 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.31 157.6 35.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.213 1.005 . . . . 0.0 110.546 -176.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -46.49 -49.3 15.84 Favored Glycine 0 CA--C 1.529 0.957 0 C-N-CA 123.808 0.718 . . . . 0.0 111.717 176.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -93.62 117.98 67.4 Favored Pre-proline 0 CA--C 1.533 0.313 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 168.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.95 1.32 5.99 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.534 2.156 . . . . 0.0 114.57 -170.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -125.74 33.62 5.06 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.902 1.228 . . . . 0.0 110.8 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -145.74 149.91 35.27 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.434 0.693 . . . . 0.0 110.206 -176.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.5 mt -115.94 107.77 15.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.894 0.878 . . . . 0.0 109.949 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.6 t -72.82 166.15 23.49 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 120.113 1.324 . . . . 0.0 109.718 169.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -38.78 -45.75 1.18 Allowed 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.742 1.617 . . . . 0.0 112.168 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.48 -48.54 81.24 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.056 0.389 . . . . 0.0 111.401 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.97 -40.95 75.08 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.24 -47.57 85.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.528 1.131 . . . . 0.0 108.993 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -59.2 -48.73 80.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.123 -0.985 . . . . 0.0 110.573 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.8 tp -52.36 -58.66 5.99 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 121.965 -0.46 . . . . 0.0 110.954 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.261 1.2 pt? -71.8 -33.86 68.91 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.12 -175.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.05 -42.79 93.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.169 1.35 . . . . 0.0 110.325 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -56.27 -53.82 52.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 119.499 1.045 . . . . 0.0 110.695 170.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -64.28 -51.52 63.09 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.413 -170.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -81.33 -40.15 24.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.165 0.986 . . . . 0.0 111.526 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -129.69 64.73 72.86 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.213 1.005 . . . . 0.0 111.631 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.69 71.72 1.46 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 124.115 3.21 . . . . 0.0 112.144 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.2 p -170.63 -73.55 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.829 0.852 . . . . 0.0 110.646 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 pp -51.91 -36.51 49.21 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.03 1.332 . . . . 0.0 114.479 -167.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.66 -30.24 68.61 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 177.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . 0.343 19.2 ptpt 49.02 -56.75 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 129.296 3.039 . . . . 0.0 117.289 -173.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.73 162.33 34.45 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 120.135 1.334 . . . . 0.0 110.987 -176.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -56.91 -42.96 80.9 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.23 1.012 . . . . 0.0 111.644 -173.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 p -52.47 -59.27 4.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.792 0.837 . . . . 0.0 109.69 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.2 m -58.02 -38.16 75.68 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 119.017 -0.515 . . . . 0.0 111.429 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tt -58.87 -40.88 85.66 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 118.909 0.777 . . . . 0.0 109.379 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -56.96 -49.92 74.23 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 110.783 176.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -62.82 -55.09 29.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.331 0.586 . . . . 0.0 109.988 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.0 tp -48.95 -53.24 20.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.41 1.084 . . . . 0.0 109.361 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.36 -47.18 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.03 0.932 . . . . 0.0 110.659 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -55.96 -45.1 78.98 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.129 0.422 . . . . 0.0 110.922 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.27 -41.52 80.95 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.168 0.587 . . . . 0.0 110.851 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.48 -56.56 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 127.251 2.22 . . . . 0.0 109.51 -174.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.63 51.0 1.4 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.674 1.59 . . . . 0.0 111.832 -169.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -50.32 -45.6 54.94 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.617 1.167 . . . . 0.0 113.049 -169.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -90.48 -48.39 7.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.184 0.594 . . . . 0.0 110.785 -176.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.4 -35.91 59.64 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-O 119.3 -0.722 . . . . 0.0 112.387 -171.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.6 t0 34.16 54.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.506 1.922 . . . . 0.0 112.851 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.67 -50.79 0.21 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -137.44 132.13 32.95 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.068 0.947 . . . . 0.0 110.266 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.0 t -87.93 114.36 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 125.676 1.59 . . . . 0.0 109.167 -175.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.5 m -79.3 159.84 27.05 Favored 'General case' 0 C--N 1.335 -0.063 0 C-N-CA 123.823 0.849 . . . . 0.0 110.819 174.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -53.12 -33.79 53.86 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.478 0.656 . . . . 0.0 111.646 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 mp0 -56.26 -47.35 78.75 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.006 0.922 . . . . 0.0 110.144 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -75.67 -36.08 60.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -58.45 -42.38 87.25 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.61 -0.681 . . . . 0.0 110.33 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -57.15 -33.97 67.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.61 -1.306 . . . . 0.0 111.898 172.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.8 t -63.24 -45.73 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.402 1.001 . . . . 0.0 109.463 171.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.5 tp -51.3 -45.35 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.498 0.59 . . . . 0.0 110.42 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t -55.98 -38.35 52.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.845 0.748 . . . . 0.0 111.227 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -58.67 -32.85 69.48 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.292 -0.88 . . . . 0.0 111.497 174.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -73.41 -55.81 5.88 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -29.22 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 O-C-N 121.852 -0.53 . . . . 0.0 111.254 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.9 m 78.23 -46.88 0.44 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 127.103 2.161 . . . . 0.0 111.616 173.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.251 173.085 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? . . . . . 0 N--CA 1.474 0.775 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.98 -50.94 81.31 Favored Pre-proline 0 N--CA 1.452 -0.35 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.09 -169.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -52.2 -46.17 34.49 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.088 1.859 . . . . 0.0 111.861 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.02 -44.87 79.19 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.764 0.826 . . . . 0.0 110.031 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.13 -50.88 71.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -65.27 -38.56 90.67 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.269 0.628 . . . . 0.0 110.106 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -56.32 -54.51 44.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 170.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.9 -55.09 22.56 Favored Glycine 0 CA--C 1.529 0.908 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.46 -61.5 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.342 1.057 . . . . 0.0 109.521 175.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -45.16 -53.6 7.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.395 1.078 . . . . 0.0 110.654 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -60.85 -48.39 82.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.338 0.655 . . . . 0.0 110.539 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.53 -44.72 93.12 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.893 0.315 . . . . 0.0 111.04 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -58.29 -62.48 1.8 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.758 0.254 . . . . 0.0 110.829 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.48 -52.24 6.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.154 1.382 . . . . 0.0 112.092 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -45.47 -32.98 2.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 114.245 -177.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 ptpp? -66.42 -22.01 66.22 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 120.535 1.516 . . . . 0.0 111.525 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -87.84 19.68 3.41 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.204 1.002 . . . . 0.0 111.183 172.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.22 -61.87 3.78 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -61.37 115.22 13.58 Favored Pre-proline 0 CA--C 1.537 0.453 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.27 -22.91 33.65 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 121.957 1.771 . . . . 0.0 111.467 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -110.11 48.68 0.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.917 0.887 . . . . 0.0 111.07 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.26 143.73 3.66 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 169.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -119.11 116.64 26.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.983 1.713 . . . . 0.0 109.978 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 95.7 p -63.11 169.52 3.38 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.024 -1.047 . . . . 0.0 110.204 169.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -45.73 -43.2 12.68 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.37 -0.832 . . . . 0.0 111.365 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.18 -47.69 73.14 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.226 -0.296 . . . . 0.0 110.412 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.94 -41.74 99.59 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.853 -0.529 . . . . 0.0 109.977 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.5 -49.74 76.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.571 1.548 . . . . 0.0 110.129 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -62.38 -40.77 97.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.121 175.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.9 -57.2 13.55 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 121.531 -0.731 . . . . 0.0 111.098 -178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.4 pt? -69.4 -35.79 76.12 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 119.229 -0.988 . . . . 0.0 112.113 -176.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.86 -40.73 95.6 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 119.453 1.024 . . . . 0.0 110.676 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -57.21 -52.19 66.33 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.468 1.031 . . . . 0.0 110.954 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -61.25 -56.05 25.02 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 110.698 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -83.31 -36.6 24.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.502 1.121 . . . . 0.0 111.799 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -130.05 60.95 55.54 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 123.678 0.791 . . . . 0.0 112.247 -172.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.23 75.55 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 124.576 3.518 . . . . 0.0 111.934 -174.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 m 173.59 -42.93 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 129.068 2.947 . . . . 0.0 108.684 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -82.55 50.6 1.68 Allowed 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.216 -0.927 . . . . 0.0 111.639 -171.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -169.33 40.66 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.968 1.307 . . . . 0.0 110.985 -178.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -70.25 77.3 0.53 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.479 -0.763 . . . . 0.0 113.0 -169.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 132.04 129.3 3.01 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 124.958 1.266 . . . . 0.0 111.453 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 44.2 tpp -56.94 -37.03 70.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.002 0.521 . . . . 0.0 109.83 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.8 p -59.59 -64.53 0.91 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.24 1.016 . . . . 0.0 109.101 169.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -44.05 -35.78 2.26 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.419 1.888 . . . . 0.0 113.146 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp -49.34 -42.79 42.79 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.419 0.687 . . . . 0.0 110.134 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.23 -50.67 68.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.597 0.359 . . . . 0.0 110.414 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.3 mp0 -66.69 -50.24 63.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.3 tt -50.57 -57.98 6.89 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -52.65 -50.73 62.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.258 1.023 . . . . 0.0 110.928 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -54.53 -42.44 70.89 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.848 0.749 . . . . 0.0 111.611 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -72.04 -20.04 61.74 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.52 0.328 . . . . 0.0 111.607 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -90.75 -58.59 2.43 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.922 1.289 . . . . 0.0 110.206 -176.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -78.81 43.32 0.49 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.513 1.925 . . . . 0.0 113.311 -167.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -79.89 58.1 2.78 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.178 0.991 . . . . 0.0 111.852 -169.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 177.43 -54.06 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 127.182 2.193 . . . . 0.0 107.934 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.85 -34.41 77.34 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.8 t70 68.64 -59.7 0.45 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 126.721 2.008 . . . . 0.0 113.243 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.2 -37.32 6.73 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.58 1.086 . . . . 0.0 112.295 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -138.11 138.49 38.75 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.778 0.831 . . . . 0.0 110.222 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.7 t -88.72 116.61 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 C-N-CA 127.106 2.162 . . . . 0.0 109.826 -172.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.9 p -70.13 168.32 15.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.742 0.817 . . . . 0.0 111.471 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -60.92 -35.56 77.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.596 0.713 . . . . 0.0 109.676 169.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -58.9 -51.99 67.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.005 0.922 . . . . 0.0 109.094 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -65.98 -40.18 91.01 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.359 0.599 . . . . 0.0 110.247 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -60.4 -34.0 73.29 Favored 'General case' 0 C--O 1.216 -0.697 0 O-C-N 121.375 -0.828 . . . . 0.0 111.479 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.6 -35.06 73.58 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.03 -1.669 . . . . 0.0 111.703 170.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.5 t -62.75 -42.39 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 121.038 -1.039 . . . . 0.0 108.739 169.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.51 -43.49 68.34 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.403 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 61.6 t -55.88 -45.14 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 120.139 1.336 . . . . 0.0 110.289 177.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.7 -50.55 71.83 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.997 -0.439 . . . . 0.0 110.165 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -58.47 -47.92 82.45 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 30.3 pt -64.57 -28.61 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.489 -0.757 . . . . 0.0 110.868 176.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m 57.93 46.0 17.34 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.542 1.137 . . . . 0.0 111.443 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 117.723 -1.132 . . . . 0.0 109.312 -178.901 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.61 -50.08 61.43 Favored Pre-proline 0 N--CA 1.451 -0.395 0 C-N-CA 124.05 0.94 . . . . 0.0 113.221 -170.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.68 -47.81 19.65 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 121.783 1.656 . . . . 0.0 112.323 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -69.62 -43.33 72.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.862 0.465 . . . . 0.0 110.332 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -54.69 -54.46 41.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.086 0.47 . . . . 0.0 109.775 177.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.07 -34.46 76.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.621 -177.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -57.78 -50.12 74.31 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 119.67 1.123 . . . . 0.0 110.558 172.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.23 -53.84 41.67 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 23.4 mt -49.45 -62.27 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -45.99 -57.18 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.007 1.323 . . . . 0.0 111.165 -177.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -66.13 -36.2 82.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.326 -0.369 . . . . 0.0 111.215 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -63.5 -49.21 74.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.672 0.669 . . . . 0.0 110.005 176.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -57.8 -52.65 64.58 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.717 -0.615 . . . . 0.0 111.363 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.61 -57.74 3.95 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.031 0.532 . . . . 0.0 110.626 172.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.45 -34.42 64.47 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.23 0.612 . . . . 0.0 112.626 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -66.84 -35.89 81.08 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.188 0.904 . . . . 0.0 110.155 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -64.18 -50.48 67.95 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 149.27 -49.0 0.58 Allowed Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -60.37 129.94 89.39 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.98 -13.76 41.12 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.094 1.863 . . . . 0.0 114.03 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -159.83 38.79 0.19 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.697 1.135 . . . . 0.0 113.569 -176.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -152.06 135.31 15.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.855 -0.528 . . . . 0.0 111.128 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.6 mt -109.2 108.93 19.74 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.809 1.244 . . . . 0.0 110.532 -173.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.4 t -70.79 165.8 22.35 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 119.43 1.014 . . . . 0.0 110.698 169.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 59.3 mtmt -38.24 -51.22 1.47 Allowed 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 126.222 1.809 . . . . 0.0 112.378 -176.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.0 mp0 -65.41 -39.44 92.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.77 -0.157 . . . . 0.0 110.709 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.74 -42.0 74.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.53 -48.68 80.06 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.574 -0.158 . . . . 0.0 110.574 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.85 -52.17 66.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.301 -0.874 . . . . 0.0 109.433 177.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 tp -51.28 -60.34 3.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 123.349 0.406 . . . . 0.0 110.363 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.281 0.9 OUTLIER -69.94 -32.33 70.54 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 119.126 -1.03 . . . . 0.0 112.467 -173.435 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.81 -44.95 84.1 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 119.962 1.255 . . . . 0.0 110.48 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -48.53 80.46 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.99 0.359 . . . . 0.0 110.289 176.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -64.81 -53.47 46.4 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.428 0.156 . . . . 0.0 110.695 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -83.8 -41.21 17.8 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.237 0.615 . . . . 0.0 111.432 -171.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -121.17 56.78 5.94 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.55 0.614 . . . . 0.0 111.962 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -64.48 149.7 89.54 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.13 1.887 . . . . 0.0 110.05 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 t 75.18 -40.08 0.42 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.562 1.545 . . . . 0.0 112.565 174.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.0 tp -51.22 -38.38 52.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.415 0.552 . . . . 0.0 109.575 170.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.33 166.46 17.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.088 0.955 . . . . 0.0 109.77 168.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -131.62 76.22 1.7 Allowed 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.75 55.47 3.81 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.145 0.878 . . . . 0.0 113.365 -169.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -87.61 -122.86 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -47.45 -42.05 21.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.073 0.949 . . . . 0.0 111.268 173.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.32 -33.96 1.79 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.868 2.067 . . . . 0.0 113.089 175.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.0 tp -51.03 -39.61 56.29 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.446 0.698 . . . . 0.0 109.759 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.36 -53.55 52.44 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 118.258 0.481 . . . . 0.0 110.562 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.17 -49.6 64.12 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -55.61 -52.68 62.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -57.78 -44.71 86.4 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.533 0.733 . . . . 0.0 110.419 178.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.35 -41.07 88.37 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.069 0.395 . . . . 0.0 111.149 178.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -68.85 -46.6 68.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.671 0.748 . . . . 0.0 109.272 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.77 -54.77 8.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.324 1.45 . . . . 0.0 110.672 -170.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.55 48.23 1.03 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.514 1.126 . . . . 0.0 112.886 -168.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -48.51 -48.29 38.29 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.429 1.491 . . . . 0.0 112.694 -169.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.15 -45.63 6.79 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.704 0.802 . . . . 0.0 110.702 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.08 88.81 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 118.166 -1.352 . . . . 0.0 113.527 -170.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.2 t0 0.34 75.1 0.0 OUTLIER 'General case' 0 C--N 1.347 0.479 0 C-N-CA 129.152 2.981 . . . . 0.0 114.261 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.04 -46.09 0.68 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 108.431 -1.867 . . . . 0.0 108.431 -169.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -151.77 135.72 16.49 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 112.11 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.2 t -88.08 116.13 29.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 127.269 2.228 . . . . 0.0 110.335 -168.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 89.4 p -67.59 164.69 18.54 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.151 0.98 . . . . 0.0 111.075 175.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -58.92 -37.67 77.19 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.22 0.533 . . . . 0.0 110.368 170.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -56.52 -54.82 41.41 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.193 0.597 . . . . 0.0 110.26 175.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -61.49 -43.43 98.88 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.035 0.445 . . . . 0.0 110.013 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.49 -41.74 77.15 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 122.058 -0.401 . . . . 0.0 111.002 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -58.31 -27.6 64.24 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.119 -0.988 . . . . 0.0 112.345 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.72 -43.02 97.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.633 1.106 . . . . 0.0 109.497 170.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -58.99 -46.75 87.39 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 172.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.93 -41.86 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 O-C-N 120.998 -1.064 . . . . 0.0 111.176 175.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -56.97 -32.76 66.38 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.647 -0.658 . . . . 0.0 111.013 175.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.0 -52.55 14.0 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.464 0.574 . . . . 0.0 110.35 172.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.3 -34.08 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.878 0.763 . . . . 0.0 111.712 -175.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.8 m 67.3 36.6 3.89 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.238 1.415 . . . . 0.0 112.148 172.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.903 171.631 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 120.675 0.274 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -58.01 22.78 Favored Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-O 118.35 -0.833 . . . . 0.0 112.642 -177.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -56.59 -37.33 97.76 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 CA-C-N 120.881 1.35 . . . . 0.0 111.241 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -64.86 -51.54 61.46 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 122.654 0.381 . . . . 0.0 110.904 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -65.66 -38.89 90.59 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.451 -0.781 . . . . 0.0 109.11 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.13 -30.73 71.28 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.254 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -59.32 -46.51 88.38 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 120.346 1.43 . . . . 0.0 109.321 169.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.97 -56.8 16.94 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.5 mt -50.02 -63.18 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 123.391 0.676 . . . . 0.0 109.637 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -43.01 -52.79 5.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.423 1.889 . . . . 0.0 110.675 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.4 -50.57 73.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.221 1.009 . . . . 0.0 110.376 -178.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -60.57 -40.39 91.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.126 -0.359 . . . . 0.0 111.449 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -61.55 -60.8 3.15 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.321 0.509 . . . . 0.0 111.811 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.77 -53.8 2.77 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.924 1.29 . . . . 0.0 111.613 177.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.05 -28.9 4.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.682 1.193 . . . . 0.0 113.673 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -60.36 -29.34 68.85 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 119.229 0.922 . . . . 0.0 111.012 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -88.07 14.8 8.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.087 0.955 . . . . 0.0 112.014 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.45 -54.71 3.66 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 121.069 -1.02 . . . . 0.0 111.021 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -49.46 119.53 9.4 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 123.834 0.854 . . . . 0.0 109.5 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -71.83 -20.64 25.8 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.024 1.816 . . . . 0.0 112.547 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -148.76 53.74 0.99 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.91 0.777 . . . . 0.0 110.977 -168.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -161.42 141.15 10.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 121.725 -0.61 . . . . 0.0 111.611 171.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 73.4 mt -115.48 108.12 16.06 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.107 1.363 . . . . 0.0 110.311 -178.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -63.63 159.5 18.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.166 -0.959 . . . . 0.0 109.749 168.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -39.18 -46.83 1.53 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.616 1.166 . . . . 0.0 113.071 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -61.09 -43.95 98.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 117.761 0.255 . . . . 0.0 111.389 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -68.69 -42.42 77.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.46 -47.34 85.86 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -56.79 -50.28 72.81 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.484 -0.76 . . . . 0.0 109.709 175.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -53.03 -57.34 10.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.656 0.382 . . . . 0.0 111.627 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.0 OUTLIER -73.44 -33.63 65.02 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 119.286 0.948 . . . . 0.0 112.472 -176.79 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.18 -38.74 92.37 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 120.691 1.587 . . . . 0.0 109.387 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.24 -50.8 71.59 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.956 -0.465 . . . . 0.0 111.413 171.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -68.57 -47.68 66.19 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.788 -171.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -88.65 -39.52 13.98 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.334 1.053 . . . . 0.0 111.466 -170.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -127.39 58.52 31.52 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.742 0.701 . . . . 0.0 112.689 -171.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.31 72.15 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 124.534 3.489 . . . . 0.0 111.661 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.1 m -178.84 -35.69 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 128.709 2.804 . . . . 0.0 109.515 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.46 -42.08 79.26 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.801 0.81 . . . . 0.0 110.198 -170.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.59 64.63 0.11 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.61 1.964 . . . . 0.0 112.285 178.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -65.62 77.66 0.07 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 111.678 -177.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.56 133.55 8.06 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -174.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 66.6 mtt -61.78 -55.11 33.58 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 122.423 -0.457 . . . . 0.0 109.922 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -46.14 33.58 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.0 1.32 . . . . 0.0 111.255 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.51 -26.81 3.72 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.788 1.635 . . . . 0.0 112.821 179.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.29 -34.3 68.55 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.438 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -55.28 -54.39 44.09 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.279 0.945 . . . . 0.0 110.505 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mp0 -65.8 -50.81 63.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.41 0.684 . . . . 0.0 109.708 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.7 tp -51.96 -55.59 19.44 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -53.45 -49.07 68.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.119 1.368 . . . . 0.0 110.728 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -53.89 -43.3 69.54 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.735 0.243 . . . . 0.0 111.282 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -76.09 -43.42 43.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 111.277 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 tt -55.48 -56.15 23.58 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.776 1.63 . . . . 0.0 109.435 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -80.24 45.8 0.78 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.098 1.359 . . . . 0.0 113.209 -168.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -77.92 60.67 2.37 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 122.029 0.919 . . . . 0.0 111.137 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -172.26 -55.0 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 126.383 1.873 . . . . 0.0 108.102 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.05 -35.33 24.49 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 41.01 50.43 3.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.251 1.82 . . . . 0.0 112.1 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 168.96 -45.51 0.22 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 -174.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -135.17 133.01 38.69 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.74 1.216 . . . . 0.0 108.448 173.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 29.4 t -86.88 112.33 22.88 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.8 p -78.67 162.19 26.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.547 0.739 . . . . 0.0 109.857 172.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -54.7 -31.61 58.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.311 0.577 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -51.43 -55.97 15.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.819 0.848 . . . . 0.0 110.543 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -72.98 -35.18 66.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -56.85 -42.82 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.698 -0.626 . . . . 0.0 110.663 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.07 -34.43 68.27 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.072 -1.017 . . . . 0.0 111.812 174.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.2 t -61.38 -42.83 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.432 1.014 . . . . 0.0 109.386 172.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.5 -45.99 80.75 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.673 -0.642 . . . . 0.0 109.882 171.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -41.2 67.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.097 -1.002 . . . . 0.0 111.378 175.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -58.27 -26.11 62.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.422 -0.798 . . . . 0.0 111.696 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -77.34 -53.74 7.32 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.853 0.752 . . . . 0.0 110.045 170.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -35.97 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.572 0.624 . . . . 0.0 111.657 -174.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.7 m 63.63 43.44 5.73 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.885 1.274 . . . . 0.0 111.984 173.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.253 1.272 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.835 177.538 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.769 -0.086 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -47.84 -47.29 63.11 Favored Pre-proline 0 N--CA 1.453 -0.293 0 CA-C-O 117.663 -1.161 . . . . 0.0 113.895 -171.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.13 -52.76 8.3 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 121.914 1.743 . . . . 0.0 112.385 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -73.58 -39.39 64.69 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.591 0.356 . . . . 0.0 110.606 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.78 -54.4 44.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.2 mp -71.54 -28.04 63.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.86 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.9 -51.2 70.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.437 1.017 . . . . 0.0 108.781 168.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.47 -54.84 27.89 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 176.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.02 -61.27 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.849 0.859 . . . . 0.0 109.789 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -45.88 -54.54 8.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.24 1.416 . . . . 0.0 110.244 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.95 -43.71 98.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -64.76 -43.16 94.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.614 1.097 . . . . 0.0 111.638 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.8 -57.36 12.35 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.299 0.954 . . . . 0.0 111.098 171.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -51.26 7.28 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.322 1.049 . . . . 0.0 111.883 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.74 -29.82 29.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -32.06 71.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.615 1.098 . . . . 0.0 110.505 174.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -87.91 21.44 2.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.35 1.46 . . . . 0.0 110.777 173.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.22 -62.23 3.4 Favored Glycine 0 CA--C 1.528 0.854 0 O-C-N 120.792 -1.192 . . . . 0.0 111.575 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.03 122.92 66.52 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 117.39 0.595 . . . . 0.0 109.671 -177.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.88 -10.31 24.65 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.188 1.925 . . . . 0.0 113.576 -172.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -143.59 42.08 1.47 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.541 1.064 . . . . 0.0 112.012 -176.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -152.08 139.44 19.46 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.287 -0.883 . . . . 0.0 111.42 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.8 mt -119.57 131.99 55.64 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.814 1.246 . . . . 0.0 110.099 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.4 p -72.92 172.6 10.62 Favored 'General case' 0 C--O 1.224 -0.277 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 167.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.401 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -57.03 -33.26 67.01 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 121.072 -1.018 . . . . 0.0 112.26 168.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -65.16 -53.33 46.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.458 0.572 . . . . 0.0 110.134 174.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -61.6 -39.85 92.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.75 -47.69 84.65 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.349 0.659 . . . . 0.0 110.263 175.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -55.57 -48.45 74.78 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.305 -0.872 . . . . 0.0 109.679 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.31 -66.62 0.37 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.578 0.751 . . . . 0.0 110.065 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.265 1.2 pt? -70.21 -29.94 66.91 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.573 -172.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -66.75 -44.5 81.3 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 120.516 1.507 . . . . 0.0 110.581 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.54 -49.39 76.89 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.311 0.505 . . . . 0.0 110.262 174.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.3 m -65.97 -50.89 62.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.171 -173.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -84.41 -40.67 17.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.843 0.857 . . . . 0.0 111.657 -173.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -121.32 61.26 10.72 Favored Pre-proline 0 CA--C 1.542 0.653 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.594 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -22.04 79.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.774 1 C-N-CA 127.685 5.59 . . . . 0.0 117.61 -175.543 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 m 47.86 33.85 3.56 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 112.849 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.16 -43.38 64.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.496 1.118 . . . . 0.0 108.987 171.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.82 22.21 7.59 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 126.035 1.734 . . . . 0.0 111.694 178.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? 68.06 -54.67 0.51 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 127.373 2.269 . . . . 0.0 112.749 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.63 -61.44 3.24 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 74.8 mtm -47.46 112.01 0.49 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.515 1.126 . . . . 0.0 109.781 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.6 m 64.68 -61.96 0.2 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.832 2.053 . . . . 0.0 111.888 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -37.05 -33.97 0.07 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 129.321 3.048 . . . . 0.0 114.342 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.8 tp -48.17 -41.0 25.77 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 123.544 0.738 . . . . 0.0 110.246 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.55 -58.93 4.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.148 0.499 . . . . 0.0 110.41 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.94 -49.99 70.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.965 0.506 . . . . 0.0 109.737 -175.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -51.57 -55.0 21.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.763 0.825 . . . . 0.0 108.906 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.401 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.2 t80 -56.58 -47.39 79.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.645 0.778 . . . . 0.0 110.992 178.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.42 -40.31 86.29 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.543 0.61 . . . . 0.0 111.284 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 68.0 tt0 -68.91 -45.99 69.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.688 0.756 . . . . 0.0 109.269 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.54 -51.51 55.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.554 1.542 . . . . 0.0 110.591 -175.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -74.49 72.35 1.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.725 1.21 . . . . 0.0 109.548 -174.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -52.15 -36.49 51.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.156 1.382 . . . . 0.0 111.506 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.19 -20.01 63.98 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.79 34.11 81.02 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -171.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.15 -4.2 59.07 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.947 0.499 . . . . 0.0 111.927 -174.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.18 16.21 75.03 Favored Glycine 0 CA--C 1.531 1.088 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -169.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -154.14 155.72 35.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.948 1.699 . . . . 0.0 107.326 -169.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.8 t -125.2 113.37 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.063 1.345 . . . . 0.0 109.016 -175.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.2 p -69.93 168.09 16.05 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 124.339 1.056 . . . . 0.0 110.857 170.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -56.49 -42.02 77.59 Favored 'General case' 0 C--N 1.342 0.246 0 O-C-N 121.865 -0.522 . . . . 0.0 109.961 169.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -58.89 -49.44 77.77 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.23 0.612 . . . . 0.0 109.585 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.36 -45.99 92.08 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.195 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -52.98 -40.55 63.83 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 122.05 -0.406 . . . . 0.0 111.094 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -55.39 -31.87 62.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.212 -0.93 . . . . 0.0 111.844 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.8 t -64.2 -35.11 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.473 -0.767 . . . . 0.0 110.168 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -66.36 -45.21 80.89 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.475 -0.765 . . . . 0.0 109.143 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t -54.02 -41.3 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.086 0.403 . . . . 0.0 110.813 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -53.47 -34.58 58.48 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.513 -0.742 . . . . 0.0 112.34 172.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -76.45 -52.64 9.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.719 0.691 . . . . 0.0 110.684 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -59.93 -35.19 59.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 121.092 0.472 . . . . 0.0 110.974 -177.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 t 69.55 -66.25 0.27 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 127.115 2.166 . . . . 0.0 111.229 -173.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 116.413 -1.755 . . . . 0.0 109.798 -168.686 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -48.23 -56.41 14.25 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.636 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -44.64 -40.28 13.93 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.838 2.359 . . . . 0.0 114.163 171.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -71.66 -41.26 68.95 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.178 0.444 . . . . 0.0 109.823 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.57 -51.3 69.11 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.08 -39.3 85.61 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.661 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.48 -51.81 67.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 119.009 0.822 . . . . 0.0 110.443 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.12 -54.56 30.92 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.2 mt -49.78 -63.07 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -43.45 -57.24 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.149 1.38 . . . . 0.0 111.007 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.48 -36.66 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.767 -174.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -62.08 -47.54 84.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.26 0.482 . . . . 0.0 110.786 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -58.43 -55.45 34.89 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.594 0.634 . . . . 0.0 111.008 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -54.26 7.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.617 0.767 . . . . 0.0 111.515 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.52 -28.88 9.3 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 178.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 119.951 1.251 . . . . 0.0 111.107 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -102.81 29.25 5.5 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.149 0.58 . . . . 0.0 110.522 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.18 -47.82 3.24 Favored Glycine 0 CA--C 1.53 0.977 0 O-C-N 121.12 -0.988 . . . . 0.0 112.421 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -39.69 115.18 1.03 Allowed Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.304 . . . . 0.0 111.734 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -69.97 -35.82 11.33 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 121.603 1.535 . . . . 0.0 110.326 178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -137.34 68.91 1.41 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.825 0.85 . . . . 0.0 109.733 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -173.75 142.96 0.95 Allowed 'General case' 0 C--N 1.343 0.315 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 169.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -117.24 109.03 16.37 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.41 1.484 . . . . 0.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.1 m -59.75 156.06 14.73 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.856 0.753 . . . . 0.0 109.1 167.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.438 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -45.87 -39.89 9.22 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -72.96 -34.02 66.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.02 0.827 . . . . 0.0 111.529 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.88 -49.23 73.52 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 174.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.72 -48.67 77.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.888 -0.507 . . . . 0.0 109.928 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -53.59 -57.67 9.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.133 0.424 . . . . 0.0 110.716 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.26 -33.56 69.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.5 tt -56.64 -59.09 5.51 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 169.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -54.66 -42.93 71.92 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.413 -0.805 . . . . 0.0 111.538 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -62.4 -49.7 74.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.432 0.56 . . . . 0.0 110.115 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.0 m -69.51 -48.94 58.91 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.932 0.396 . . . . 0.0 110.023 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -81.85 -41.23 21.31 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 118.318 -0.849 . . . . 0.0 111.742 -169.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -112.4 73.86 1.45 Allowed Pre-proline 0 CA--C 1.541 0.63 0 CA-C-N 119.273 0.942 . . . . 0.0 112.018 -170.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -61.17 158.71 33.57 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.47 2.113 . . . . 0.0 109.537 172.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.5 m 66.79 -41.12 0.39 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.402 1.481 . . . . 0.0 113.973 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.0 mp -76.5 -40.36 50.37 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.21 0.914 . . . . 0.0 109.63 -172.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.39 9.56 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 178.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -79.4 65.52 4.59 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.979 1.263 . . . . 0.0 109.749 -170.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 177.31 65.39 0.06 OUTLIER Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -175.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -67.53 -57.93 5.62 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.852 0.461 . . . . 0.0 109.959 -173.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.9 p -54.64 -44.6 73.35 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.659 0.742 . . . . 0.0 109.79 171.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.51 -13.19 0.87 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.663 1.585 . . . . 0.0 113.188 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp -48.61 -40.04 26.12 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.426 1.012 . . . . 0.0 109.379 169.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -54.17 -53.44 53.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.983 0.42 . . . . 0.0 110.6 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -63.95 -53.59 47.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -51.67 -55.79 17.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.023 0.529 . . . . 0.0 109.714 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.438 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 16.9 t80 -55.66 -47.86 75.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.835 0.854 . . . . 0.0 110.754 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -56.42 -39.99 73.97 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.025 0.375 . . . . 0.0 111.932 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -49.07 17.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 109.937 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 tt -62.26 -56.81 14.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.932 1.693 . . . . 0.0 109.615 -174.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -80.87 43.61 0.7 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.965 0.906 . . . . 0.0 112.293 -169.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -61.99 -32.98 73.5 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -168.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.13 -47.52 8.03 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 122.802 0.441 . . . . 0.0 110.698 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.97 -39.23 54.88 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 119.604 -0.553 . . . . 0.0 111.866 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 t0 42.52 53.21 4.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.364 1.466 . . . . 0.0 112.136 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.74 -55.22 0.2 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -134.64 141.1 46.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.038 0.935 . . . . 0.0 109.548 173.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 35.5 t -88.55 120.36 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 C-N-CA 125.209 1.404 . . . . 0.0 109.529 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -71.86 163.47 27.77 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 123.946 0.898 . . . . 0.0 111.107 172.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -58.52 -35.13 71.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.861 0.838 . . . . 0.0 109.876 170.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.77 -51.68 68.3 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.439 1.096 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.36 -44.5 94.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.95 0.405 . . . . 0.0 110.123 174.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -53.96 -44.3 70.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.399 0.68 . . . . 0.0 110.889 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -55.03 -31.3 60.97 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.34 -0.85 . . . . 0.0 112.396 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.57 -37.8 79.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 119.013 0.824 . . . . 0.0 110.262 172.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.37 -50.27 70.59 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.2 t -53.51 -42.91 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 117.86 0.3 . . . . 0.0 111.071 -177.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -51.89 -34.57 41.87 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.197 0.599 . . . . 0.0 111.58 176.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -82.09 -49.8 9.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.984 0.514 . . . . 0.0 110.591 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -35.58 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.101 0.864 . . . . 0.0 111.25 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m 73.06 -57.92 0.62 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.945 2.098 . . . . 0.0 112.139 173.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.145 -1.407 . . . . 0.0 111.825 178.57 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.4 tptm . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 121.727 0.775 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.3 -53.13 18.78 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 125.713 1.605 . . . . 0.0 112.685 -174.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -49.67 -49.62 15.35 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.367 2.045 . . . . 0.0 112.786 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.05 -39.24 79.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.497 0.319 . . . . 0.0 110.585 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.86 -52.29 65.7 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 174.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 23.3 mt -63.75 -39.58 94.63 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.283 1.033 . . . . 0.0 110.569 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -58.15 -52.86 63.8 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.243 0.617 . . . . 0.0 110.4 172.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.3 -55.14 28.06 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.4 mt -43.62 -64.83 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.028 1.331 . . . . 0.0 109.455 171.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -45.59 -53.29 9.34 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.61 1.164 . . . . 0.0 110.7 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.51 -48.61 80.97 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.903 0.481 . . . . 0.0 110.977 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.96 -43.45 95.04 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 122.004 -0.435 . . . . 0.0 111.167 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -62.02 -58.44 7.84 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 111.081 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.17 -53.07 5.24 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.102 0.961 . . . . 0.0 111.928 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.8 -27.9 8.23 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.376 1.071 . . . . 0.0 113.646 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -60.93 -28.72 69.15 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.555 1.071 . . . . 0.0 110.809 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -93.08 21.06 6.13 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.37 1.068 . . . . 0.0 111.284 174.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.31 -59.31 3.64 Favored Glycine 0 CA--C 1.528 0.854 0 O-C-N 121.327 -0.858 . . . . 0.0 111.291 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -55.03 116.98 12.67 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.544 0.737 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.82 -19.95 30.42 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.995 1.797 . . . . 0.0 112.115 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -129.4 58.19 1.63 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.295 0.638 . . . . 0.0 111.914 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -171.69 140.2 1.3 Allowed 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 167.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.4 mt -112.02 119.04 37.12 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.814 1.646 . . . . 0.0 109.622 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -61.91 169.19 2.71 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.834 1.197 . . . . 0.0 109.752 168.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -52.24 -36.96 53.87 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.004 -1.06 . . . . 0.0 111.875 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.24 -51.06 63.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.16 -41.94 97.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.48 -48.63 80.25 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.867 1.267 . . . . 0.0 109.605 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 tttp -58.38 -51.16 70.99 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -49.03 -61.99 1.77 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.339 1.055 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.277 1.0 OUTLIER -68.09 -32.73 73.25 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.322 -175.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -63.39 -46.77 84.9 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 119.925 1.238 . . . . 0.0 110.449 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -56.09 -52.37 64.55 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.025 173.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.0 m -66.52 -47.97 71.23 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.039 -170.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -87.56 -41.55 13.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.576 0.75 . . . . 0.0 111.981 -172.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -114.57 84.0 9.45 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 118.67 0.668 . . . . 0.0 110.671 -169.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -60.13 166.0 9.72 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 121.995 1.797 . . . . 0.0 110.694 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.4 m 70.98 -50.78 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.105 1.362 . . . . 0.0 112.444 -172.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.2 mt -54.22 -42.75 70.17 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.023 0.829 . . . . 0.0 111.441 -173.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -11.06 0.93 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.6 tttp -52.98 -34.75 57.43 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.288 0.949 . . . . 0.0 109.846 169.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -73.54 62.73 1.89 Allowed Glycine 0 CA--C 1.533 1.21 0 N-CA-C 110.641 -0.983 . . . . 0.0 110.641 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 52.2 ttm -67.12 -72.39 0.17 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.649 0.779 . . . . 0.0 110.118 -170.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -54.16 -37.14 64.11 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.483 0.713 . . . . 0.0 110.489 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -17.41 1.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.635 1.574 . . . . 0.0 112.841 176.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.7 tp -46.13 -41.2 12.14 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.656 1.116 . . . . 0.0 110.041 170.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -53.55 -55.55 24.59 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.354 0.597 . . . . 0.0 110.937 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.01 -49.07 63.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.483 0.713 . . . . 0.0 109.45 -174.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.07 -59.13 4.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.698 0.799 . . . . 0.0 108.976 177.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -56.85 -43.68 81.4 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.032 0.533 . . . . 0.0 110.804 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.51 -42.75 78.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.037 0.38 . . . . 0.0 111.19 176.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -71.12 -38.38 72.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.189 0.596 . . . . 0.0 110.174 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.87 -51.21 42.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.934 1.694 . . . . 0.0 110.406 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -78.76 66.95 4.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.016 0.927 . . . . 0.0 109.38 -169.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -70.11 67.71 0.3 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.719 2.007 . . . . 0.0 109.997 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 176.83 -36.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 127.66 2.384 . . . . 0.0 108.465 -172.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.57 40.29 86.19 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -73.07 -18.83 61.28 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 122.667 -0.313 . . . . 0.0 110.604 176.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.85 0.73 90.4 Favored Glycine 0 CA--C 1.531 1.082 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -142.93 163.14 33.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.553 1.941 . . . . 0.0 107.017 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.4 t -119.59 115.71 48.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 125.988 1.715 . . . . 0.0 108.243 -173.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.8 p -81.1 163.71 22.95 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 124.238 1.015 . . . . 0.0 110.565 176.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -55.07 -32.95 62.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.119 0.485 . . . . 0.0 111.025 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.99 -34.25 77.15 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.015 0.926 . . . . 0.0 112.069 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -82.74 -42.09 18.43 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -57.6 -44.04 85.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.816 0.846 . . . . 0.0 111.262 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -60.48 -24.67 65.46 Favored 'General case' 0 CA--C 1.529 0.137 0 O-C-N 120.754 -1.216 . . . . 0.0 112.427 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.31 -48.14 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 C-N-CA 119.747 -0.781 . . . . 0.0 108.919 170.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -48.81 -42.48 36.16 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.129 -0.357 . . . . 0.0 110.447 172.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 78.0 t -53.34 -36.71 27.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.0 111.792 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.65 -29.84 70.93 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.249 -0.907 . . . . 0.0 110.79 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -78.46 -49.16 13.94 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.035 0.934 . . . . 0.0 110.111 177.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.3 pt -63.0 -37.06 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-N 118.475 0.579 . . . . 0.0 111.171 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.5 p 65.82 -57.7 0.33 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 112.722 -172.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 . . . . . 0 C--O 1.251 1.183 0 C-N-CA 126.064 1.746 . . . . 0.0 112.76 179.304 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 52.2 tptt . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 120.338 0.113 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.74 -55.01 45.42 Favored Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.896 -169.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.89 -48.96 14.75 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.563 2.176 . . . . 0.0 112.38 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.86 -46.49 84.75 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.812 0.845 . . . . 0.0 110.184 -178.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -57.5 -48.26 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.4 mt -63.24 -39.73 95.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.735 0.814 . . . . 0.0 110.449 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -54.86 -53.17 58.86 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.517 0.727 . . . . 0.0 109.826 170.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.06 -55.7 26.81 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.0 mt -46.8 -61.25 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 124.302 1.041 . . . . 0.0 109.114 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -46.63 -56.8 5.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.637 0.775 . . . . 0.0 110.964 -178.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -55.04 -47.12 75.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.72 0.408 . . . . 0.0 111.605 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -59.81 -47.18 86.76 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.948 -0.47 . . . . 0.0 111.023 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -61.59 -53.94 49.54 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 118.487 0.585 . . . . 0.0 110.933 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.99 -52.92 8.3 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.302 0.641 . . . . 0.0 112.02 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.33 -20.84 1.19 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.38 -32.44 70.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.668 1.122 . . . . 0.0 111.192 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -95.98 -175.1 3.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.423 0.689 . . . . 0.0 110.556 176.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -58.33 -53.36 46.41 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 123.465 0.555 . . . . 0.0 112.677 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -84.07 117.28 68.29 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 117.809 0.805 . . . . 0.0 109.642 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -74.39 5.01 3.94 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.533 2.155 . . . . 0.0 113.938 -174.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.47 38.56 1.26 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.344 0.975 . . . . 0.0 111.571 174.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.28 145.98 29.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 122.191 -0.318 . . . . 0.0 110.704 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -114.76 108.35 16.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.377 0.671 . . . . 0.0 110.342 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.7 t -65.77 161.55 20.61 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 168.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.405 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 67.4 mttm -38.66 -51.08 1.66 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.625 1.17 . . . . 0.0 113.042 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -66.79 -41.49 87.56 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.63 -42.94 95.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.0 tp -56.2 -61.78 2.16 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 172.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -46.59 -46.15 19.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.538 1.063 . . . . 0.0 111.732 -178.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.4 -29.36 68.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.676 1.19 . . . . 0.0 109.741 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 tt -79.32 -58.65 3.11 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.95 -60.94 1.96 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.928 2.091 . . . . 0.0 111.914 -170.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.18 -46.63 79.29 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -177.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -65.69 -49.61 67.9 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 111.704 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -83.03 -36.09 25.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.08 -171.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -124.56 61.1 27.99 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.583 0.753 . . . . 0.0 110.685 -173.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.08 65.7 5.17 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.054 3.169 . . . . 0.0 111.978 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.1 m -160.53 -68.48 0.07 Allowed 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.095 0.958 . . . . 0.0 110.284 174.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.6 tp -78.32 60.64 2.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.404 0.681 . . . . 0.0 110.799 -169.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -179.04 -44.79 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.265 1.026 . . . . 0.0 112.114 -173.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.8 tmtm? 61.15 -68.31 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.036 1.734 . . . . 0.0 110.445 -168.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 118.99 101.63 2.0 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 124.795 1.188 . . . . 0.0 111.577 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.1 pmm? -164.29 -150.85 0.15 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.776 1.63 . . . . 0.0 107.077 170.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.1 p -46.18 -32.26 2.88 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.183 1.793 . . . . 0.0 112.74 176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 m -47.1 -28.19 1.66 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.738 1.615 . . . . 0.0 112.92 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp -51.39 -45.2 62.41 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 118.174 0.443 . . . . 0.0 109.921 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -60.29 -46.23 90.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -176.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.39 -54.85 40.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.1 tp -50.36 -55.84 13.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.968 0.507 . . . . 0.0 109.749 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.405 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 12.5 t80 -51.16 -48.48 61.85 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.101 0.961 . . . . 0.0 111.074 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.08 -44.52 94.72 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.367 0.53 . . . . 0.0 111.241 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.85 -36.77 80.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.301 0.64 . . . . 0.0 110.814 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.36 -56.81 4.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.985 1.714 . . . . 0.0 109.774 -173.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -80.17 48.75 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.933 1.693 . . . . 0.0 112.605 -168.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -56.0 -39.23 71.58 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -170.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.63 -48.11 7.79 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.857 0.463 . . . . 0.0 110.8 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.51 -36.22 44.56 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.228 -0.762 . . . . 0.0 112.314 -171.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 37.8 t0 34.83 56.49 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.386 1.874 . . . . 0.0 112.552 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 166.16 -46.68 0.27 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -173.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -136.36 129.25 31.02 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.633 1.173 . . . . 0.0 109.246 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.37 115.05 27.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -84.23 156.44 22.0 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.994 1.318 . . . . 0.0 109.99 178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -55.23 -31.94 61.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.477 0.656 . . . . 0.0 111.985 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -57.01 -43.97 82.36 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.868 0.867 . . . . 0.0 110.555 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -77.63 -38.71 47.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -59.78 -37.4 78.97 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 121.676 -0.64 . . . . 0.0 110.715 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -56.59 -34.1 66.86 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.303 -1.498 . . . . 0.0 112.117 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -64.09 -44.76 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.283 0.947 . . . . 0.0 109.022 170.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -51.75 -41.82 61.88 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.799 -0.563 . . . . 0.0 110.558 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.53 -36.36 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 119.339 0.972 . . . . 0.0 111.615 178.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -64.64 -48.21 75.67 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.81 -0.556 . . . . 0.0 109.588 174.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -61.97 -46.66 88.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.3 pt -63.74 -30.59 50.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.893 0.769 . . . . 0.0 110.045 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.1 m 64.2 49.91 2.51 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 125.648 1.579 . . . . 0.0 109.726 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.483 -1.722 . . . . 0.0 111.62 -170.577 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.7 -48.35 91.1 Favored Pre-proline 0 N--CA 1.451 -0.414 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.276 -169.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.4 -47.24 28.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.016 1.811 . . . . 0.0 112.046 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -68.04 -43.28 79.06 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.625 0.77 . . . . 0.0 110.02 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.36 -52.02 64.89 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.551 0.74 . . . . 0.0 109.239 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.5 mt -64.25 -37.35 87.18 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.236 0.614 . . . . 0.0 110.427 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -57.96 -48.28 80.42 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.597 0.635 . . . . 0.0 110.312 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.9 -55.56 27.21 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 177.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -50.21 -62.21 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.721 0.808 . . . . 0.0 109.417 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -43.25 -54.53 4.5 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 125.032 1.333 . . . . 0.0 110.443 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.2 -46.82 88.91 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.253 1.021 . . . . 0.0 110.449 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.71 -45.7 93.2 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.226 -0.296 . . . . 0.0 110.927 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -58.14 -58.79 6.89 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.075 0.398 . . . . 0.0 111.396 173.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.77 -53.04 7.82 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.318 1.447 . . . . 0.0 111.724 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.41 -31.41 9.58 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -58.32 -33.0 69.01 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.27 0.941 . . . . 0.0 111.121 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -100.45 38.84 1.44 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.189 0.519 . . . . 0.0 109.996 172.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.94 -69.8 2.4 Favored Glycine 0 CA--C 1.524 0.648 0 O-C-N 121.453 -0.779 . . . . 0.0 111.229 173.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.65 103.45 0.37 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.161 -174.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -64.69 -22.37 64.32 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.126 1.884 . . . . 0.0 110.855 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -88.82 1.31 55.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.059 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 117.453 2.39 . . . . 0.0 117.453 -168.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 59.7 mt -111.23 126.22 54.64 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.3 1.44 . . . . 0.0 110.467 176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.5 p -71.99 171.32 12.05 Favored 'General case' 0 C--O 1.224 -0.249 0 O-C-N 121.307 -0.87 . . . . 0.0 109.513 169.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -47.85 -45.3 30.01 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.104 0.866 . . . . 0.0 111.207 168.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.16 -52.04 65.41 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -61.2 -42.18 98.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.292 0.568 . . . . 0.0 110.361 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.92 -48.95 79.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.77 1.628 . . . . 0.0 109.691 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -59.56 -47.67 84.64 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.343 -0.848 . . . . 0.0 110.272 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.9 tp -52.09 -59.79 3.95 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.016 0.926 . . . . 0.0 111.208 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.3 pt? -68.77 -34.86 76.28 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.82 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.41 -43.45 94.35 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.628 1.104 . . . . 0.0 110.679 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -55.27 -53.98 49.23 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 119.639 1.109 . . . . 0.0 110.466 172.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -65.38 -54.24 31.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.014 -169.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -81.43 -37.63 27.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.475 0.71 . . . . 0.0 111.728 -174.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -131.07 63.24 69.59 Favored Pre-proline 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 112.549 -168.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.45 74.71 0.38 Allowed 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.204 3.269 . . . . 0.0 112.692 -173.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -168.67 -60.34 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.168 1.787 . . . . 0.0 108.843 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.77 49.44 1.05 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.309 1.043 . . . . 0.0 112.743 -169.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -165.83 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.146 1.378 . . . . 0.0 112.953 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -77.65 69.42 3.89 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.442 -0.786 . . . . 0.0 110.556 -172.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -174.96 93.45 0.09 OUTLIER Glycine 0 CA--C 1.526 0.749 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 95.9 mmm -49.98 -55.29 15.2 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.26 1.024 . . . . 0.0 111.001 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 p -61.33 -55.81 27.49 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.298 1.039 . . . . 0.0 109.576 174.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -48.07 -31.38 5.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.005 1.722 . . . . 0.0 113.205 -176.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp -49.51 -43.29 45.36 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.4 0.68 . . . . 0.0 109.733 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.26 -50.16 72.12 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.539 0.336 . . . . 0.0 110.323 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.08 -53.39 50.4 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.468 0.707 . . . . 0.0 109.892 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.3 tp -50.43 -57.72 7.36 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.541 0.736 . . . . 0.0 109.254 178.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -52.73 -48.87 66.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.957 0.903 . . . . 0.0 111.322 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -55.92 -46.13 78.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.538 0.608 . . . . 0.0 111.209 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -71.14 -40.6 71.26 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 121.025 0.441 . . . . 0.0 110.593 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.64 -55.89 25.76 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.305 1.442 . . . . 0.0 109.442 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -80.81 51.72 1.58 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.184 1.794 . . . . 0.0 111.85 -169.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -49.64 -44.09 47.27 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.371 1.069 . . . . 0.0 113.412 -169.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.05 -48.33 7.04 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.144 0.577 . . . . 0.0 110.888 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.72 -35.32 55.2 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.643 -170.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.3 t0 31.59 56.48 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.792 2.037 . . . . 0.0 113.055 -175.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.03 -48.75 0.22 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -134.0 127.96 33.39 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.736 1.214 . . . . 0.0 108.946 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.7 t -87.26 114.14 25.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 125.236 1.414 . . . . 0.0 108.694 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.5 m -77.75 154.31 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -48.24 -41.01 26.4 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.446 0.641 . . . . 0.0 111.571 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -64.46 -36.09 83.06 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.067 0.547 . . . . 0.0 110.601 -177.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -74.75 -44.7 48.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -51.37 -40.62 59.59 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.496 0.718 . . . . 0.0 110.474 174.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -55.37 -32.93 63.0 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.647 -0.658 . . . . 0.0 111.903 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.57 -41.85 91.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.186 -0.946 . . . . 0.0 109.719 172.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.09 -44.32 97.53 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.5 t -54.53 -40.28 49.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -53.35 -43.55 67.81 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.264 0.938 . . . . 0.0 110.474 173.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -70.92 -40.6 72.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.406 0.682 . . . . 0.0 112.209 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 pt -65.16 -39.96 87.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.56 1.073 . . . . 0.0 109.777 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.8 m 72.18 -48.71 0.68 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.938 2.095 . . . . 0.0 114.193 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 117.641 -1.171 . . . . 0.0 110.141 -168.833 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -49.37 69.34 Favored Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-O 118.057 -0.973 . . . . 0.0 113.589 -169.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.17 -46.8 21.43 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.814 1.676 . . . . 0.0 112.061 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -72.34 -38.53 68.58 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.801 0.441 . . . . 0.0 110.646 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.72 -55.36 33.12 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.998 -0.438 . . . . 0.0 110.013 174.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.69 -33.53 76.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.3 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -56.9 -50.72 71.67 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.261 0.937 . . . . 0.0 110.517 170.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.65 -52.32 49.04 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -51.95 -62.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.775 0.83 . . . . 0.0 109.519 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -42.47 -55.47 3.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.643 1.177 . . . . 0.0 110.179 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -57.86 -52.45 65.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.904 0.881 . . . . 0.0 111.752 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -62.11 -38.66 89.75 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.769 -0.772 . . . . 0.0 111.72 -176.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -61.98 -60.56 3.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.595 0.634 . . . . 0.0 111.189 169.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.91 -48.14 16.23 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.609 1.564 . . . . 0.0 113.498 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.35 -29.12 1.54 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.859 1.264 . . . . 0.0 113.41 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -57.86 -33.77 69.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.066 0.848 . . . . 0.0 111.29 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -91.03 25.14 2.54 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.443 0.697 . . . . 0.0 111.529 173.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.81 -64.03 3.06 Favored Glycine 0 CA--C 1.526 0.735 0 O-C-N 121.206 -0.934 . . . . 0.0 110.962 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -60.72 111.26 3.82 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 117.65 0.725 . . . . 0.0 109.756 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -67.74 -18.32 47.67 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 121.699 1.6 . . . . 0.0 111.48 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -106.16 35.96 2.75 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.018 0.927 . . . . 0.0 111.013 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -160.5 136.08 8.14 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 116.738 2.125 . . . . 0.0 116.738 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.8 mt -113.81 123.12 49.05 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.169 1.788 . . . . 0.0 110.234 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.9 p -66.0 167.23 10.13 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.1 -1.0 . . . . 0.0 110.147 169.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 60.2 mtpt -43.56 -47.56 7.39 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.38 -0.825 . . . . 0.0 111.709 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -67.25 -46.84 72.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -176.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -62.02 -44.99 95.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.197 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.58 -49.42 77.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.15 -53.8 38.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.934 0.788 . . . . 0.0 110.084 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.28 -51.15 71.17 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.265 1.026 . . . . 0.0 108.531 -170.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.9 tt -56.58 -55.77 29.74 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.135 -1.393 . . . . 0.0 108.378 177.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.79 -40.75 73.13 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.981 0.809 . . . . 0.0 111.227 -177.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.7 -49.78 73.73 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.218 0.917 . . . . 0.0 109.076 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.5 m -66.35 -51.51 56.43 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.709 -173.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -83.9 -41.64 17.2 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.259 1.024 . . . . 0.0 111.535 -172.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -125.38 61.55 35.83 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.145 0.978 . . . . 0.0 111.78 -170.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.06 72.28 2.1 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.646 2.897 . . . . 0.0 111.253 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.6 p -174.79 -65.4 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 124.747 1.219 . . . . 0.0 109.337 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.6 mt -50.3 -31.51 14.53 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.676 1.59 . . . . 0.0 114.102 -169.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -18.44 61.65 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . 0.362 0.0 OUTLIER 51.45 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 128.5 2.72 . . . . 0.0 114.478 -168.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -125.06 168.31 17.2 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.62 1.105 . . . . 0.0 110.525 175.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 64.7 mtm -65.68 -49.03 70.07 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.006 -0.703 . . . . 0.0 109.793 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.2 m -49.62 -44.82 47.64 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.774 1.23 . . . . 0.0 111.86 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -10.55 4.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.977 0.911 . . . . 0.0 113.279 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.78 -45.02 78.24 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 119.515 1.052 . . . . 0.0 108.31 169.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -56.06 -49.51 73.58 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.037 0.446 . . . . 0.0 109.874 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.09 -54.66 34.38 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.305 0.642 . . . . 0.0 110.125 -179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.4 tp -54.77 -56.04 23.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.445 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 19.2 t80 -52.87 -47.0 68.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.699 1.199 . . . . 0.0 110.782 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -58.38 -41.21 84.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.93 0.332 . . . . 0.0 111.077 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -71.69 -39.23 70.36 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.349 0.595 . . . . 0.0 110.462 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -74.05 -55.44 6.11 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.919 1.688 . . . . 0.0 110.443 -171.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -79.19 40.3 0.41 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.697 1.199 . . . . 0.0 113.814 -167.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.61 67.72 7.69 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.165 -0.96 . . . . 0.0 111.577 -172.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 177.43 -49.91 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 127.469 2.308 . . . . 0.0 108.095 170.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.47 -43.0 20.95 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 177.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 66.13 -46.51 0.42 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 128.04 2.536 . . . . 0.0 114.737 176.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.94 -41.39 7.16 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 118.981 0.809 . . . . 0.0 111.866 173.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -138.07 136.78 37.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.189 0.996 . . . . 0.0 109.813 -176.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.76 117.26 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 126.464 1.905 . . . . 0.0 109.186 -172.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -81.66 156.4 25.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.171 0.988 . . . . 0.0 110.343 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -52.9 -38.28 61.57 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 118.589 0.631 . . . . 0.0 111.005 -175.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -61.02 -39.83 91.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.4 0.68 . . . . 0.0 110.379 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.51 -44.36 62.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -54.55 -39.32 67.59 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 122.882 0.473 . . . . 0.0 111.199 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -58.98 -27.5 65.46 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.168 -0.958 . . . . 0.0 111.469 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -63.31 -44.67 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.318 -0.864 . . . . 0.0 109.203 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.9 tp -56.3 -47.1 79.34 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 171.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 49.3 t -55.45 -45.6 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 119.765 1.166 . . . . 0.0 111.362 178.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -58.11 -32.03 67.72 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.474 -0.766 . . . . 0.0 111.62 174.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -69.18 -55.67 9.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.753 0.706 . . . . 0.0 111.006 170.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.69 -39.43 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 118.814 0.734 . . . . 0.0 110.605 -173.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 69.25 44.91 0.91 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.441 1.096 . . . . 0.0 111.391 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--O 1.251 1.146 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 168.749 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 tptm . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 110.571 -0.159 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.76 -51.38 74.39 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.358 -0.829 . . . . 0.0 112.762 -173.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.59 -46.22 34.78 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.018 1.812 . . . . 0.0 111.915 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.4 mp0 -67.39 -43.17 81.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.575 0.75 . . . . 0.0 110.264 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.19 -52.18 65.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.87 -37.12 83.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.46 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -56.47 -51.85 66.91 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 119.112 0.869 . . . . 0.0 110.649 171.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.44 -55.02 30.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -49.18 -59.77 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.762 0.825 . . . . 0.0 109.39 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -48.2 -57.91 5.26 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.929 1.292 . . . . 0.0 110.392 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -54.6 -46.42 73.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.302 0.641 . . . . 0.0 111.399 179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -59.29 -48.94 79.72 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.927 -0.483 . . . . 0.0 110.951 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -59.05 -56.82 17.32 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.055 0.388 . . . . 0.0 111.216 175.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.21 -53.93 3.88 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.852 1.261 . . . . 0.0 111.365 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.76 -28.12 8.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -59.05 -31.22 68.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.603 1.092 . . . . 0.0 110.853 174.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -83.17 12.71 4.85 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.094 1.758 . . . . 0.0 111.421 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.37 -59.46 3.66 Favored Glycine 0 CA--C 1.529 0.926 0 O-C-N 120.457 -1.402 . . . . 0.0 110.466 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -52.11 113.97 4.87 Favored Pre-proline 0 CA--C 1.534 0.355 0 C-N-CA 123.852 0.861 . . . . 0.0 109.575 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.73 2.5 6.91 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 122.039 1.826 . . . . 0.0 113.322 -172.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -153.17 28.15 0.51 Allowed 'General case' 0 C--N 1.342 0.268 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -172.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -147.62 136.65 22.19 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.605 0.639 . . . . 0.0 110.722 174.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 52.8 mt -107.11 108.91 20.6 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.996 0.918 . . . . 0.0 110.795 -175.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -64.94 163.57 14.26 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.051 -1.03 . . . . 0.0 109.136 167.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -38.63 -42.71 0.81 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.811 1.644 . . . . 0.0 112.073 174.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.48 -45.83 82.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.305 -0.247 . . . . 0.0 111.59 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -62.72 -48.17 80.38 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 175.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.18 -47.65 80.69 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.79 0.836 . . . . 0.0 110.376 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -46.87 86.17 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.545 -0.722 . . . . 0.0 109.546 176.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.8 tp -59.37 -52.94 63.47 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.958 -0.464 . . . . 0.0 110.683 -173.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.259 1.1 pt? -71.37 -34.12 70.15 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.679 -175.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 mp -67.14 -42.25 84.73 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.214 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -58.99 -48.51 81.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.228 0.922 . . . . 0.0 111.265 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 m -63.72 -56.38 16.1 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.066 0.46 . . . . 0.0 110.844 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.42 -34.64 18.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.584 1.154 . . . . 0.0 112.495 -168.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.32 59.62 38.18 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.16 0.984 . . . . 0.0 111.374 -171.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.08 154.63 50.03 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.564 2.176 . . . . 0.0 110.085 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.3 m 69.53 -48.35 0.61 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.702 1.601 . . . . 0.0 112.759 -172.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 mt -57.23 -31.87 65.96 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.291 1.036 . . . . 0.0 112.017 -176.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -15.04 22.07 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 173.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.1 pttt 48.84 49.12 19.56 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.488 1.915 . . . . 0.0 114.243 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.52 143.64 14.94 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.301 0.953 . . . . 0.0 111.38 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.5 ttm -66.7 -55.27 15.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.212 -0.581 . . . . 0.0 110.64 -173.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -48.3 -45.34 34.85 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.234 1.013 . . . . 0.0 111.108 178.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.29 -21.02 1.22 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.557 1.943 . . . . 0.0 113.322 178.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.27 -41.66 50.92 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.71 0.804 . . . . 0.0 110.114 174.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -51.07 70.77 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.22 -54.46 29.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.7 tp -50.3 -55.61 14.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.486 0.715 . . . . 0.0 109.79 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -53.03 -51.46 61.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.109 0.564 . . . . 0.0 110.331 177.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -57.51 -38.57 74.86 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.434 0.561 . . . . 0.0 112.162 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.19 -33.78 72.15 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.237 0.615 . . . . 0.0 110.195 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -80.39 -56.13 4.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.628 1.171 . . . . 0.0 110.824 -173.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.02 40.87 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.462 1.505 . . . . 0.0 114.816 -166.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -50.46 -47.89 56.74 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -170.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.28 -34.32 17.74 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.242 0.617 . . . . 0.0 110.472 173.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.33 -33.94 66.79 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 126.69 2.09 . . . . 0.0 113.709 -174.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.6 t0 32.62 56.83 0.41 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.322 2.249 . . . . 0.0 112.63 172.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 134.32 -45.32 1.12 Allowed Glycine 0 CA--C 1.525 0.679 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.341 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -138.62 134.08 33.28 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.115 0.957 . . . . 0.0 110.579 -175.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.6 t -87.96 119.49 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 124.097 0.959 . . . . 0.0 109.651 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 84.3 p -82.56 158.03 23.27 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.914 0.886 . . . . 0.0 111.132 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -55.61 -37.61 68.37 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.127 0.489 . . . . 0.0 110.801 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -56.59 -47.47 79.5 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.833 1.253 . . . . 0.0 109.973 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.8 -36.98 76.13 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.385 0.612 . . . . 0.0 109.61 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -56.27 -37.52 69.93 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.797 -0.564 . . . . 0.0 110.74 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -55.77 -35.96 66.81 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.645 -1.284 . . . . 0.0 111.896 171.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.56 -48.76 83.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.77 -40.76 30.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.417 0.687 . . . . 0.0 111.583 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.3 t -44.97 -42.98 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.93 175.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -66.52 -26.47 67.16 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 122.05 -0.406 . . . . 0.0 110.969 -175.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -79.26 -58.69 3.09 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 175.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 26.0 pt -54.71 -39.35 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.185 -175.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m 71.83 -55.59 0.66 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.369 1.467 . . . . 0.0 111.486 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 . . . . . 0 C--O 1.25 1.113 0 C-N-CA 125.963 1.705 . . . . 0.0 110.727 169.473 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 tptm . . . . . 0 N--CA 1.475 0.777 0 CA-C-O 120.319 0.104 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.88 -49.41 74.17 Favored Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-O 117.877 -1.059 . . . . 0.0 113.187 -171.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.45 -47.11 25.95 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.043 1.829 . . . . 0.0 112.552 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.7 -46.14 73.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.365 0.666 . . . . 0.0 109.844 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -55.24 -50.98 68.07 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 109.544 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.92 -37.49 86.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.94 0.896 . . . . 0.0 110.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -57.03 -50.31 73.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.863 0.756 . . . . 0.0 110.353 170.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.17 -55.39 28.5 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 178.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.1 mt -50.93 -58.87 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -46.39 -57.68 4.43 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.988 1.315 . . . . 0.0 111.026 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.39 -37.88 88.3 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.267 0.485 . . . . 0.0 111.071 -175.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -61.79 -43.79 98.15 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.74 -0.6 . . . . 0.0 111.022 177.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -60.02 -58.25 9.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.018 -0.426 . . . . 0.0 111.199 171.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.07 -53.53 4.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.214 1.006 . . . . 0.0 111.492 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.56 -32.39 5.36 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -59.96 -31.24 69.69 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.339 0.972 . . . . 0.0 110.846 177.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -84.47 12.7 6.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.062 1.745 . . . . 0.0 111.399 175.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.8 -60.16 3.77 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 120.491 -1.381 . . . . 0.0 110.618 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -52.87 112.21 3.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.856 0.862 . . . . 0.0 108.984 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.22 -5.25 16.69 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.05 1.833 . . . . 0.0 113.01 -171.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -142.33 27.83 1.71 Allowed 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.087 0.858 . . . . 0.0 113.155 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -154.31 140.71 18.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.026 0.83 . . . . 0.0 112.445 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.1 mt -114.62 112.54 23.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.527 1.131 . . . . 0.0 111.58 -175.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.1 p -62.05 165.08 5.93 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.989 -1.069 . . . . 0.0 110.112 168.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -40.67 -46.74 2.66 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 123.915 0.886 . . . . 0.0 111.705 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.61 -52.44 65.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.496 0.318 . . . . 0.0 110.242 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -65.87 -39.75 90.99 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.035 0.445 . . . . 0.0 110.082 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.26 -49.14 78.29 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.81 1.644 . . . . 0.0 109.261 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -58.82 -46.85 86.69 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.386 -0.821 . . . . 0.0 110.315 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.8 tp -52.54 -58.64 6.12 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.41 -0.806 . . . . 0.0 111.824 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.279 1.2 pt? -69.97 -34.74 73.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 119.246 -0.982 . . . . 0.0 112.099 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.3 -42.06 99.0 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 119.535 1.062 . . . . 0.0 110.542 175.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -57.21 -52.91 63.43 Favored 'General case' 0 CA--C 1.527 0.064 0 CA-C-N 119.232 0.924 . . . . 0.0 110.924 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.9 m -62.32 -52.22 64.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.722 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -89.11 -34.96 16.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.07 0.948 . . . . 0.0 112.89 -168.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -124.59 81.23 60.48 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -168.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -45.56 150.92 1.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.597 3.531 . . . . 0.0 113.156 169.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 t 69.85 -56.38 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.118 1.767 . . . . 0.0 111.919 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -53.56 -35.61 60.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.229 1.012 . . . . 0.0 111.49 -174.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -13.53 2.76 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 176.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -76.98 45.61 0.44 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.205 1.366 . . . . 0.0 112.668 -169.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.52 59.66 4.07 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 174.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 92.1 mtp -59.21 103.13 0.16 Allowed 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.1 m 68.64 -54.21 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.841 2.056 . . . . 0.0 110.978 -169.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.5 p -43.83 -18.37 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.836 2.855 . . . . 0.0 115.135 173.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.69 -41.65 32.34 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 120.539 1.518 . . . . 0.0 108.681 168.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -54.16 -51.94 62.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 122.17 0.188 . . . . 0.0 110.955 177.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -64.05 -53.56 47.93 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.328 0.651 . . . . 0.0 110.097 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.9 tp -50.05 -57.44 7.6 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.602 0.761 . . . . 0.0 109.119 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -54.1 -46.26 72.06 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.856 0.863 . . . . 0.0 111.403 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.92 -44.48 86.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.808 0.731 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -72.45 -46.01 56.92 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.868 0.366 . . . . 0.0 110.179 -176.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.06 -59.56 4.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.379 1.472 . . . . 0.0 109.048 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -80.37 47.53 0.93 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.93 1.692 . . . . 0.0 110.556 -173.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ttmm -57.07 -34.42 68.26 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -167.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.39 -50.34 5.86 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.079 0.552 . . . . 0.0 110.869 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.19 -39.44 52.62 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.278 -171.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.9 t0 36.39 54.12 1.03 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.368 1.867 . . . . 0.0 112.469 -174.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.68 -57.6 0.08 OUTLIER Glycine 0 CA--C 1.525 0.683 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 -175.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -132.39 137.94 47.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.455 1.102 . . . . 0.0 108.582 172.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.1 t -88.22 114.7 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 126.02 1.728 . . . . 0.0 108.569 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.7 p -76.47 159.57 30.29 Favored 'General case' 0 C--N 1.335 -0.047 0 C-N-CA 123.741 0.816 . . . . 0.0 110.53 172.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -55.33 -34.79 64.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.499 0.666 . . . . 0.0 111.174 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.88 -49.44 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.093 0.957 . . . . 0.0 110.393 174.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.65 -40.27 69.8 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -55.22 -41.85 72.58 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 121.796 -0.565 . . . . 0.0 110.601 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -57.59 -31.72 66.47 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.482 -0.761 . . . . 0.0 112.365 176.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.58 -28.84 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.558 -0.714 . . . . 0.0 110.932 171.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -74.08 -45.46 49.1 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.202 -0.936 . . . . 0.0 108.608 169.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 90.9 t -54.34 -45.77 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.267 -0.896 . . . . 0.0 111.76 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -59.33 -21.55 59.94 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.335 -0.853 . . . . 0.0 111.913 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -78.67 -54.0 6.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.513 0.597 . . . . 0.0 109.577 169.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.41 -35.13 36.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 118.521 0.6 . . . . 0.0 111.559 -176.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 m 75.13 -37.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.013 1.725 . . . . 0.0 113.278 173.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 . . . . . 0 C--O 1.252 1.185 0 CA-C-O 117.223 -1.37 . . . . 0.0 111.834 176.03 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.32 -50.66 55.7 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.85 -176.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.82 -44.37 31.95 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.266 1.977 . . . . 0.0 112.711 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -71.67 -42.25 67.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.896 0.478 . . . . 0.0 110.312 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.29 -52.08 65.84 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.142 0.496 . . . . 0.0 109.86 174.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.4 mt -64.14 -37.9 89.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.522 0.729 . . . . 0.0 109.826 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -55.88 -52.59 63.56 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 118.292 0.497 . . . . 0.0 110.047 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.01 -55.68 20.12 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.25 -54.75 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -46.25 -54.81 8.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.793 1.237 . . . . 0.0 109.626 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.59 -44.93 93.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.467 0.707 . . . . 0.0 110.824 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -61.25 -45.22 95.42 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 117.957 0.344 . . . . 0.0 111.375 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -60.79 -60.51 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.013 -0.429 . . . . 0.0 111.084 172.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.35 -49.78 6.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.037 1.735 . . . . 0.0 112.758 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.36 -32.28 11.03 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.956 0.903 . . . . 0.0 113.396 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -62.8 -30.99 71.89 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.243 -0.911 . . . . 0.0 110.797 176.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.54 24.21 1.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.688 1.195 . . . . 0.0 110.753 170.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.75 -66.36 2.76 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 121.273 -0.892 . . . . 0.0 111.175 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -67.63 114.01 17.39 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.154 0.582 . . . . 0.0 109.822 -175.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -64.89 -22.23 63.34 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.167 1.911 . . . . 0.0 111.942 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -105.86 35.57 2.85 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.362 0.665 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -160.09 132.48 6.39 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.671 1.123 . . . . 0.0 113.93 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.86 152.76 23.47 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 125.889 1.676 . . . . 0.0 107.047 172.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.8 p -94.45 174.07 7.31 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -53.21 -38.93 63.32 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 119.649 1.113 . . . . 0.0 112.337 167.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.7 -51.88 63.07 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -62.64 -40.42 96.95 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.267 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.84 -49.86 75.79 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.132 0.573 . . . . 0.0 109.476 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -53.89 -51.04 64.98 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.621 -0.674 . . . . 0.0 109.978 175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -51.16 -62.23 1.74 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.416 0.686 . . . . 0.0 111.676 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.0 OUTLIER -70.79 -30.64 67.16 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.876 -176.156 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.28 -42.99 96.15 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 120.398 1.453 . . . . 0.0 109.63 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -58.32 -50.54 73.25 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.856 0.753 . . . . 0.0 110.838 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 m -61.15 -56.03 25.48 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.044 0.449 . . . . 0.0 110.719 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -87.13 -40.7 14.39 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.089 1.356 . . . . 0.0 112.078 -169.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -120.68 57.05 5.42 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 123.872 0.869 . . . . 0.0 111.033 -170.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -58.96 155.31 39.44 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.189 1.926 . . . . 0.0 109.941 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.9 m 70.08 -42.9 0.53 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.172 1.389 . . . . 0.0 113.283 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.5 mt -60.08 -37.58 80.34 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.721 1.146 . . . . 0.0 111.098 -176.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.58 -16.88 62.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 173.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? 67.4 -64.38 0.26 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.855 2.062 . . . . 0.0 111.671 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.67 176.83 44.05 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -52.02 66.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.963 0.381 . . . . 0.0 111.857 -177.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.3 m -52.14 -48.87 64.65 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.393 0.677 . . . . 0.0 111.559 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -18.95 32.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.666 1.187 . . . . 0.0 112.944 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.2 tp -52.71 -40.09 62.67 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 119.433 1.015 . . . . 0.0 109.227 170.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.75 -53.01 60.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.672 0.669 . . . . 0.0 110.495 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -62.5 -58.25 8.28 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.8 mp -53.36 -52.7 58.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.457 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 7.6 t80 -57.43 -45.85 84.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.703 0.401 . . . . 0.0 110.641 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -58.28 -41.68 84.9 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.062 0.392 . . . . 0.0 111.336 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -69.89 -44.12 70.4 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.526 0.679 . . . . 0.0 109.768 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.55 -52.22 23.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.272 1.429 . . . . 0.0 110.851 -172.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -75.87 74.4 2.8 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.063 0.945 . . . . 0.0 109.691 -172.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -53.52 -33.68 55.38 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.34 1.056 . . . . 0.0 111.788 174.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.98 -22.68 66.48 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 176.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 54.28 41.05 69.86 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 124.817 1.198 . . . . 0.0 112.201 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -110.54 4.32 20.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.699 1.2 . . . . 0.0 112.109 -177.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.58 85.13 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 118.308 0.504 . . . . 0.0 111.918 -177.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -134.3 168.89 18.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.026 1.33 . . . . 0.0 109.285 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 67.5 t -139.55 109.39 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.05 1.34 . . . . 0.0 107.52 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.7 m -80.71 161.02 24.78 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 122.825 0.45 . . . . 0.0 111.098 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -51.55 -38.97 56.84 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-O 121.423 0.63 . . . . 0.0 110.753 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.09 -38.3 90.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.057 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.27 -45.35 63.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.4 -40.51 62.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.894 0.478 . . . . 0.0 110.966 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -55.52 -30.78 61.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.983 0.513 . . . . 0.0 111.882 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.4 t -61.7 -41.01 88.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 121.371 -0.831 . . . . 0.0 109.645 172.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -48.46 81.61 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 172.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 68.0 t -53.01 -43.82 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 O-C-N 121.724 -0.61 . . . . 0.0 111.485 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -55.52 -30.77 61.29 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.641 -0.662 . . . . 0.0 111.935 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -76.66 -52.03 10.41 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.516 0.598 . . . . 0.0 110.427 172.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.64 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 119.046 0.839 . . . . 0.0 111.609 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 m 73.58 -64.32 0.4 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.078 2.151 . . . . 0.0 112.576 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.107 -0.949 . . . . 0.0 112.073 -176.272 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 54.6 tttt . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.515 0.197 . . . . 0.0 111.351 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -47.84 -49.59 57.13 Favored Pre-proline 0 N--CA 1.45 -0.453 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -169.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.47 -54.3 5.29 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.03 1.82 . . . . 0.0 112.604 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -74.26 -35.96 63.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.387 0.275 . . . . 0.0 111.71 -177.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.97 -56.56 20.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.558 0.694 . . . . 0.0 109.303 176.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.64 -31.31 70.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.298 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.79 -50.24 71.01 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.706 1.139 . . . . 0.0 110.381 169.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.39 -55.41 22.35 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.599 -1.0 . . . . 0.0 110.599 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 48.5 mt -54.43 -59.12 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -42.32 -54.71 3.65 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.784 1.234 . . . . 0.0 110.539 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.53 -45.04 92.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.707 0.803 . . . . 0.0 110.062 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -59.9 -45.47 92.45 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 122.32 -0.238 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -61.02 -58.85 6.7 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.15 0.432 . . . . 0.0 111.329 173.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -46.84 7.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.398 1.479 . . . . 0.0 112.748 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.33 -30.81 8.1 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.668 1.187 . . . . 0.0 113.681 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -73.28 -27.89 61.81 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.42 0.555 . . . . 0.0 111.14 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -72.3 151.31 42.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.295 1.438 . . . . 0.0 109.451 -178.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -45.83 -45.86 13.73 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 124.129 0.871 . . . . 0.0 112.238 172.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -88.58 105.3 9.3 Favored Pre-proline 0 CA--C 1.533 0.327 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 169.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -66.56 -9.17 23.26 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.361 2.041 . . . . 0.0 113.648 -169.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -118.0 28.14 8.57 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.055 0.843 . . . . 0.0 110.741 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -149.37 156.4 41.99 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.147 0.43 . . . . 0.0 112.018 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.2 mt -110.24 110.32 21.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.917 0.887 . . . . 0.0 109.202 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.6 p -69.33 163.54 24.89 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 169.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -39.16 -46.09 1.41 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.202 1.001 . . . . 0.0 113.343 177.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -74.38 -32.63 62.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.191 0.451 . . . . 0.0 112.077 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -69.23 -45.58 69.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.93 -46.22 82.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.264 1.425 . . . . 0.0 109.434 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -57.38 -53.3 59.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 121.585 -0.697 . . . . 0.0 109.75 173.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -54.28 -53.37 54.61 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.878 0.471 . . . . 0.0 111.171 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.285 1.2 pt? -70.89 -35.17 72.21 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 118.903 -1.119 . . . . 0.0 112.081 -176.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.63 -36.59 84.13 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 119.591 1.087 . . . . 0.0 110.185 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -51.85 67.28 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.765 0.711 . . . . 0.0 109.808 173.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -63.75 -56.23 17.15 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 110.032 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -83.56 -36.99 23.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.239 1.016 . . . . 0.0 111.842 -169.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -130.01 56.51 24.94 Favored Pre-proline 0 CA--C 1.541 0.599 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -169.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.75 72.38 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 124.458 3.439 . . . . 0.0 111.24 -177.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.0 m -177.05 -39.15 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 127.91 2.484 . . . . 0.0 109.161 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.66 -46.38 84.32 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 110.231 -172.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.36 71.82 1.28 Allowed 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.533 0.733 . . . . 0.0 109.315 172.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.19 76.68 0.09 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.634 1.173 . . . . 0.0 110.089 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.65 102.63 1.64 Allowed Glycine 0 CA--C 1.523 0.586 0 N-CA-C 106.931 -2.468 . . . . 0.0 106.931 -169.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 57.5 ttm -31.79 -48.99 0.16 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.158 2.183 . . . . 0.0 114.648 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 m -40.98 -37.91 0.89 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.03 1.732 . . . . 0.0 113.709 176.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.7 p -54.97 -16.98 3.15 Favored 'General case' 0 C--N 1.338 0.103 0 CA-C-O 118.022 -0.989 . . . . 0.0 113.477 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.9 tp -46.42 -41.32 13.58 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.632 1.105 . . . . 0.0 109.749 169.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -54.01 -55.75 24.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.205 0.202 . . . . 0.0 110.861 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.63 -47.99 68.03 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -173.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 77.3 mt -50.91 -61.95 1.9 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -55.22 -44.37 75.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.323 0.51 . . . . 0.0 111.267 -178.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -56.64 -43.8 80.67 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.348 0.259 . . . . 0.0 111.085 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -72.21 -43.37 64.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.465 0.65 . . . . 0.0 109.863 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.73 -51.53 54.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.985 1.714 . . . . 0.0 110.562 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -77.3 71.87 3.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 109.673 -172.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -46.43 -43.12 16.21 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.573 1.549 . . . . 0.0 111.956 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.06 -19.47 63.28 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.431 0.692 . . . . 0.0 112.424 -178.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.52 83.08 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.667 -0.973 . . . . 0.0 110.667 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -76.17 -12.58 60.12 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.531 -0.393 . . . . 0.0 111.501 -177.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.44 6.78 88.85 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -169.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -147.95 160.67 42.57 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.47 1.908 . . . . 0.0 107.315 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 42.4 t -116.43 115.39 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 125.54 1.536 . . . . 0.0 108.098 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.8 p -73.6 166.61 22.95 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.392 1.077 . . . . 0.0 110.622 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -53.2 -43.65 67.35 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.115 0.483 . . . . 0.0 110.156 171.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -64.16 -46.82 82.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 122.932 0.493 . . . . 0.0 109.724 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.94 -47.01 88.39 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.25 0.548 . . . . 0.0 109.652 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -54.1 -39.89 66.8 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.857 0.863 . . . . 0.0 111.181 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -56.2 -27.34 54.28 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.422 -0.799 . . . . 0.0 111.902 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.85 -46.86 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 119.102 0.865 . . . . 0.0 109.189 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -40.53 69.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.417 0.687 . . . . 0.0 109.856 174.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.4 t -54.7 -28.29 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.378 -0.826 . . . . 0.0 112.173 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -67.52 -38.59 84.47 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 120.002 -1.686 . . . . 0.0 110.435 173.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.32 -43.08 78.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.963 0.505 . . . . 0.0 110.366 178.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.8 -37.29 79.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.773 174.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.3 m 74.09 -42.88 0.52 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.838 2.055 . . . . 0.0 112.639 177.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.551 1.14 . . . . 0.0 111.254 173.666 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.8 pttt . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -46.44 -54.6 17.56 Favored Pre-proline 0 N--CA 1.453 -0.298 0 CA-C-O 117.665 -1.159 . . . . 0.0 111.564 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -40.58 -45.57 4.57 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.032 2.488 . . . . 0.0 114.622 170.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -72.4 -42.5 65.08 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.886 0.766 . . . . 0.0 110.297 -176.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -57.08 -51.73 68.11 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.71 -41.28 90.46 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.088 0.955 . . . . 0.0 110.268 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.72 -51.36 69.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.334 0.516 . . . . 0.0 110.046 173.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.54 -56.75 18.45 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 177.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.89 -58.63 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 123.952 0.901 . . . . 0.0 109.289 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -47.57 -55.55 9.0 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.479 1.512 . . . . 0.0 110.402 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.65 -45.71 88.73 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.132 0.573 . . . . 0.0 111.618 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -58.92 -49.17 78.83 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.131 -0.355 . . . . 0.0 110.827 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -58.29 -56.45 21.97 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.013 -0.43 . . . . 0.0 111.197 174.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.02 -51.68 7.63 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.704 1.202 . . . . 0.0 112.48 177.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.05 -30.97 6.92 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 177.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -60.67 -33.1 72.32 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.32 -0.862 . . . . 0.0 111.302 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.3 31.36 1.73 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.493 0.588 . . . . 0.0 111.021 171.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.33 -68.26 2.69 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 174.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -54.48 105.85 0.58 Allowed Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.847 1.259 . . . . 0.0 109.85 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -80.4 32.67 0.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.687 2.258 . . . . 0.0 112.329 -169.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.57 25.51 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.395 -0.816 . . . . 0.0 112.9 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -150.96 142.05 23.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.963 0.505 . . . . 0.0 110.8 -175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.6 mt -120.39 129.9 54.13 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.83 1.252 . . . . 0.0 107.911 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 t -93.55 168.07 11.27 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 167.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -48.14 -34.62 10.18 Favored 'General case' 0 N--CA 1.461 0.125 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -170.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -70.5 -40.63 73.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.959 -0.463 . . . . 0.0 110.742 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.4 -42.42 75.12 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.51 -48.56 80.44 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 122.435 0.294 . . . . 0.0 110.987 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -62.69 -42.43 99.63 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 118.031 -1.468 . . . . 0.0 109.207 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.1 tp -54.49 -59.17 5.05 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.99 -0.444 . . . . 0.0 111.192 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.254 1.3 pt? -70.28 -35.33 73.65 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 119.032 -1.067 . . . . 0.0 112.245 -174.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -42.51 98.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 119.414 1.006 . . . . 0.0 110.119 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.22 -48.48 81.55 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.275 0.943 . . . . 0.0 111.11 173.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -61.19 -55.95 26.28 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.043 0.449 . . . . 0.0 110.562 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -87.1 -38.68 16.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.451 1.1 . . . . 0.0 112.069 -169.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.75 58.88 30.83 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 124.118 0.967 . . . . 0.0 111.758 -170.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -58.88 158.76 23.52 Favored 'Trans proline' 0 N--CA 1.449 -1.125 0 C-N-CA 122.278 1.985 . . . . 0.0 110.076 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.6 m 70.44 -41.21 0.49 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.15 1.38 . . . . 0.0 113.466 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.89 -39.06 84.06 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.849 1.204 . . . . 0.0 111.082 -176.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -9.73 38.25 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 174.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.9 tttt 65.22 -69.15 0.1 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.965 2.106 . . . . 0.0 112.336 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 170.74 137.47 2.3 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.646 -0.582 . . . . 0.0 111.646 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.5 mpp? 24.07 -97.33 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 129.013 2.925 . . . . 0.0 113.362 170.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.6 m -45.12 -40.78 7.26 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.994 1.718 . . . . 0.0 112.977 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.61 -29.92 53.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.357 0.663 . . . . 0.0 111.457 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.0 tp -52.68 -40.49 62.97 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.203 0.601 . . . . 0.0 110.135 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.74 -51.91 67.05 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.28 0.491 . . . . 0.0 110.014 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -66.9 -49.48 65.45 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.777 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.1 tp -54.51 -53.28 56.46 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -54.92 -47.89 73.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.486 0.714 . . . . 0.0 110.624 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -58.4 -40.44 82.42 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.168 0.44 . . . . 0.0 111.305 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.23 -47.8 63.73 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 121.668 0.747 . . . . 0.0 109.33 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -64.57 -57.45 9.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.609 1.563 . . . . 0.0 110.537 -174.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -74.34 75.18 1.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -51.01 -37.09 42.98 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.651 1.18 . . . . 0.0 111.504 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.51 -23.67 66.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.616 0.766 . . . . 0.0 112.662 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.13 37.45 91.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.197 0.903 . . . . 0.0 112.017 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -98.83 0.03 43.45 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.034 0.934 . . . . 0.0 112.392 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.4 16.6 70.91 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 -177.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -142.22 160.76 39.6 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.182 0.993 . . . . 0.0 110.102 -176.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.46 103.95 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 76.5 p -68.15 173.6 4.56 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.355 0.662 . . . . 0.0 109.454 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -58.36 -35.87 72.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.737 0.78 . . . . 0.0 110.343 171.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -62.54 -51.69 66.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.857 0.863 . . . . 0.0 109.727 178.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.95 -46.29 88.38 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.02 -41.5 71.4 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.51 -0.744 . . . . 0.0 111.559 -177.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -56.54 -27.81 58.53 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.455 -0.778 . . . . 0.0 112.584 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.53 -35.98 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 119.432 1.015 . . . . 0.0 110.484 170.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.88 -48.76 73.1 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 171.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 63.8 t -54.08 -42.76 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 122.112 -0.368 . . . . 0.0 111.03 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -51.45 -34.29 34.57 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.07 -0.394 . . . . 0.0 111.397 175.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -82.64 -46.01 13.81 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.161 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.91 -34.04 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.863 1.211 . . . . 0.0 110.978 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.4 m 82.37 -50.06 0.2 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 127.036 2.135 . . . . 0.0 112.486 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 117.239 -1.363 . . . . 0.0 110.643 -177.565 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.2 -49.1 63.11 Favored Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 124.402 1.081 . . . . 0.0 113.302 -172.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.72 -46.68 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.098 1.866 . . . . 0.0 112.109 175.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -68.85 -41.96 77.77 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.307 0.643 . . . . 0.0 110.064 -177.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.22 -52.11 65.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.03 -34.08 76.93 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 119.405 -0.331 . . . . 0.0 110.405 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -59.14 -51.06 71.66 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.708 0.685 . . . . 0.0 110.57 169.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.75 -54.19 34.72 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.4 mt -44.61 -64.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 125.084 1.354 . . . . 0.0 109.651 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -45.25 -53.96 7.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.74 0.816 . . . . 0.0 110.443 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.16 -49.95 74.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.934 0.894 . . . . 0.0 111.863 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.16 -45.57 92.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.529 1.058 . . . . 0.0 110.944 -179.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -58.74 -53.55 57.11 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.88 -0.513 . . . . 0.0 110.759 177.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -53.93 19.32 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.889 1.276 . . . . 0.0 111.463 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.08 -39.39 59.64 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.406 -0.808 . . . . 0.0 112.105 172.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -69.63 -36.71 76.36 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.799 0.727 . . . . 0.0 110.967 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -48.59 80.48 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.25 -57.06 0.51 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.31 108.77 3.11 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -59.57 -26.69 82.87 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.389 2.059 . . . . 0.0 111.5 -175.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -95.6 5.82 50.5 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 116.761 -1.59 . . . . 0.0 112.774 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -151.97 141.85 22.03 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -168.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.1 mt -106.65 127.76 53.62 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 125.62 1.568 . . . . 0.0 109.535 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.2 p -71.92 171.4 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.287 -0.883 . . . . 0.0 109.044 168.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 8.4 mtmp? -45.86 -44.61 14.49 Favored 'General case' 0 C--O 1.226 -0.173 0 O-C-N 121.637 -0.664 . . . . 0.0 110.969 167.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mp0 -68.39 -47.69 66.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.746 0.418 . . . . 0.0 109.936 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -61.62 -41.74 97.9 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.48 -48.77 80.38 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.702 1.201 . . . . 0.0 109.851 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -59.87 -48.9 79.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.228 -0.92 . . . . 0.0 110.093 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.4 tp -50.98 -60.86 2.64 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.88 0.872 . . . . 0.0 111.244 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 1.1 pt? -69.18 -31.67 70.45 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 119.063 -1.055 . . . . 0.0 112.199 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -65.92 -43.55 87.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 119.994 1.27 . . . . 0.0 110.55 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -55.84 -54.02 49.59 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.013 0.824 . . . . 0.0 110.677 171.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.0 m -65.67 -52.71 49.52 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.564 0.221 . . . . 0.0 111.289 -169.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -80.56 -39.05 28.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.634 0.773 . . . . 0.0 111.346 -175.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -126.88 62.58 51.88 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.364 -169.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.47 75.17 0.38 Allowed 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 124.711 3.607 . . . . 0.0 112.215 -173.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.2 m 176.19 -42.2 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 129.381 3.073 . . . . 0.0 108.414 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -81.72 51.96 1.81 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.77 0.828 . . . . 0.0 110.535 -172.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -166.47 18.13 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.103 1.361 . . . . 0.0 112.025 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -75.31 70.4 2.22 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.481 0.713 . . . . 0.0 110.514 -173.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 167.58 84.9 0.06 OUTLIER Glycine 0 CA--C 1.524 0.642 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 66.8 mtm -58.71 -59.77 4.88 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 122.412 -0.463 . . . . 0.0 110.7 -173.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.6 p -52.94 -47.14 68.29 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.852 0.861 . . . . 0.0 109.919 173.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -18.85 3.03 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.431 1.492 . . . . 0.0 113.027 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp -50.89 -40.55 56.93 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 119.651 1.114 . . . . 0.0 109.677 171.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -52.84 -57.2 11.0 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.087 0.47 . . . . 0.0 109.92 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.49 -52.26 64.19 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.336 0.655 . . . . 0.0 110.114 -175.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.18 -54.5 35.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.755 0.822 . . . . 0.0 109.141 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 38.5 t80 -57.79 -45.3 86.23 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.038 0.535 . . . . 0.0 111.337 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.91 -42.94 95.01 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.144 0.884 . . . . 0.0 111.105 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.19 -50.52 67.77 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.807 0.813 . . . . 0.0 109.266 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -60.08 4.4 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 126.328 1.851 . . . . 0.0 109.715 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -80.35 49.82 1.19 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.908 1.683 . . . . 0.0 112.407 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.86 -65.91 0.56 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.315 0.579 . . . . 0.0 109.797 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -83.79 68.29 9.86 Favored 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 121.699 -0.625 . . . . 0.0 109.647 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 174.67 -38.01 0.11 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.858 -0.412 . . . . 0.0 112.301 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.7 t70 67.84 -60.44 0.4 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.224 2.21 . . . . 0.0 113.834 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.77 -28.67 8.18 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.618 1.104 . . . . 0.0 112.699 -174.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -143.64 131.68 21.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.985 0.914 . . . . 0.0 110.411 -177.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 37.9 t -87.43 113.77 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 C-N-CA 127.303 2.241 . . . . 0.0 108.349 -171.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 96.7 p -79.72 165.68 22.57 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.095 0.558 . . . . 0.0 110.359 173.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -55.42 -33.94 63.98 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.917 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.96 -54.82 29.36 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.413 0.685 . . . . 0.0 110.226 173.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -69.11 -38.63 79.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -58.44 -39.51 80.03 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 121.763 -0.586 . . . . 0.0 110.778 179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -57.62 -35.17 70.12 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.464 1.484 . . . . 0.0 111.967 174.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.98 -39.57 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 121.205 -0.935 . . . . 0.0 109.3 171.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.39 -43.85 88.69 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 169.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.7 t -58.79 -35.35 55.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 119.587 1.085 . . . . 0.0 110.731 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -61.28 -59.35 5.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -55.73 -44.97 78.03 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -173.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 20.4 pt -55.97 -23.48 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.112 0.869 . . . . 0.0 111.885 177.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.2 m 75.59 -53.37 0.64 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 126.026 1.731 . . . . 0.0 112.635 170.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.089 0 C-N-CA 125.561 1.545 . . . . 0.0 112.604 -173.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.3 tttm . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 110.537 -0.172 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.25 -51.37 42.64 Favored Pre-proline 0 N--CA 1.453 -0.323 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.456 -169.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.62 -40.79 30.68 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.54 2.16 . . . . 0.0 113.294 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -71.1 -46.19 62.22 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.115 0.566 . . . . 0.0 109.994 -176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -58.37 -50.78 72.42 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.38 -40.81 95.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.997 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -56.96 -50.88 71.29 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 118.556 0.616 . . . . 0.0 110.527 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.67 -54.47 32.78 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 57.1 mt -50.01 -64.36 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 123.93 0.892 . . . . 0.0 109.352 175.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -45.73 -52.19 11.39 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.18 1.392 . . . . 0.0 110.239 -178.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.82 -45.96 91.56 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.626 1.171 . . . . 0.0 110.457 -175.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.29 -49.04 79.19 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.252 -0.28 . . . . 0.0 110.557 178.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -56.28 -60.54 3.36 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 117.972 0.351 . . . . 0.0 111.388 175.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.28 -55.12 3.46 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.923 1.689 . . . . 0.0 111.914 177.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.14 -26.57 6.87 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -58.89 -31.84 68.96 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.68 1.127 . . . . 0.0 110.564 175.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -91.79 25.64 2.67 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.584 1.153 . . . . 0.0 110.973 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.72 -64.55 2.97 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.24 113.56 7.75 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.597 0.759 . . . . 0.0 109.709 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.5 -20.14 21.01 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.189 1.926 . . . . 0.0 112.138 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -103.09 16.46 26.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 117.982 -1.009 . . . . 0.0 112.643 -171.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -154.9 141.79 19.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -168.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.4 mt -119.99 135.19 55.01 Favored 'General case' 0 C--N 1.345 0.402 0 C-N-CA 125.658 1.583 . . . . 0.0 109.575 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.9 p -74.13 172.67 11.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.105 0.866 . . . . 0.0 109.181 168.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.406 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -55.33 -38.42 68.71 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.041 -1.037 . . . . 0.0 112.152 168.306 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.31 -52.41 64.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.84 -40.78 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.55 -47.31 86.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.368 1.067 . . . . 0.0 110.027 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -57.24 -51.44 69.36 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.664 -0.815 . . . . 0.0 109.536 172.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.1 tp -52.6 -55.86 19.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.629 0.372 . . . . 0.0 111.773 -173.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.26 1.3 pt? -69.85 -35.55 74.82 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 119.143 -1.023 . . . . 0.0 112.249 -177.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -64.77 -40.4 95.2 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 120.562 1.528 . . . . 0.0 109.936 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.34 -52.18 65.53 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.007 0.523 . . . . 0.0 111.003 171.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.55 -49.6 58.24 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 -172.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -86.47 -37.5 18.21 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.173 0.989 . . . . 0.0 111.589 -169.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -126.47 62.04 46.15 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.22 1.008 . . . . 0.0 111.649 -175.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.15 73.76 0.49 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.853 3.702 . . . . 0.0 112.016 -174.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 m 176.92 -36.64 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 128.624 2.77 . . . . 0.0 109.675 -176.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -67.13 -43.94 81.1 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.839 -0.538 . . . . 0.0 110.679 -169.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.482 ' CD1' ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.59 49.85 0.05 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.452 2.301 . . . . 0.0 113.916 177.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.41 75.12 0.38 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.777 1.231 . . . . 0.0 113.36 -170.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.61 137.95 7.11 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.502 1.525 . . . . 0.0 110.332 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -60.94 -51.36 69.62 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.378 -0.484 . . . . 0.0 110.318 -179.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 m -51.94 -46.49 64.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.924 0.89 . . . . 0.0 110.425 177.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.13 -25.59 13.81 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.23 1.412 . . . . 0.0 112.519 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp -55.26 -40.67 71.25 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.887 0.767 . . . . 0.0 110.008 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.48 -55.39 32.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -60.82 -53.74 53.71 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.069 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.48 -54.57 39.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.793 0.837 . . . . 0.0 109.183 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.406 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 41.2 t80 -57.51 -45.42 84.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.515 0.726 . . . . 0.0 111.196 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -61.18 -45.03 96.29 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 118.799 0.727 . . . . 0.0 110.89 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.13 -47.07 84.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.559 0.695 . . . . 0.0 109.346 -176.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -61.2 2.52 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.887 1.675 . . . . 0.0 109.77 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -80.58 54.99 2.2 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.476 1.51 . . . . 0.0 111.75 -168.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -53.58 -48.44 69.19 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 123.214 0.605 . . . . 0.0 111.396 -174.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.41 -48.62 26.62 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.695 0.398 . . . . 0.0 111.687 -176.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -82.07 -39.82 11.09 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.739 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.4 t0 38.19 52.79 1.65 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.713 1.605 . . . . 0.0 112.028 -170.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 174.61 -50.07 0.14 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 -172.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -138.76 128.93 25.52 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.561 1.144 . . . . 0.0 109.691 179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 66.3 t -87.37 99.8 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 -178.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.3 m -68.53 155.52 39.79 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -46.5 -36.99 7.25 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.542 0.686 . . . . 0.0 112.178 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -60.62 -41.19 94.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.718 0.807 . . . . 0.0 110.927 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -72.34 -40.84 67.09 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 174.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.4 -42.63 64.19 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.708 -0.62 . . . . 0.0 110.961 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -39.74 20.09 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.667 -0.645 . . . . 0.0 112.494 172.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.1 t -61.42 -39.84 84.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 O-C-N 121.746 -0.596 . . . . 0.0 110.149 175.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.44 -51.63 69.07 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t -53.54 -41.71 46.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 117.929 0.331 . . . . 0.0 111.057 -176.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -51.68 -37.11 49.19 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.049 0.539 . . . . 0.0 111.502 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -78.46 -50.93 10.78 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.081 0.552 . . . . 0.0 110.62 174.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.55 -32.04 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 118.831 0.741 . . . . 0.0 111.724 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.2 m 75.54 -44.27 0.52 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.944 2.098 . . . . 0.0 113.255 171.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 125.997 1.719 . . . . 0.0 111.93 179.067 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.65 -53.7 51.09 Favored Pre-proline 0 N--CA 1.45 -0.45 0 CA-C-O 117.695 -1.145 . . . . 0.0 112.403 -174.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -50.75 11.14 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.367 2.045 . . . . 0.0 112.315 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.64 -48.04 82.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.192 0.597 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.04 -50.17 71.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.764 0.426 . . . . 0.0 109.852 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.65 -38.7 92.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.108 0.963 . . . . 0.0 109.593 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -59.56 -52.37 65.83 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.271 0.487 . . . . 0.0 110.387 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.51 -54.22 36.06 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.8 mt -45.19 -64.32 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.558 1.143 . . . . 0.0 109.497 172.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -48.21 -56.13 8.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.463 1.505 . . . . 0.0 110.534 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -56.91 -47.02 81.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.56 0.344 . . . . 0.0 110.889 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -60.51 -44.17 96.29 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.984 -0.448 . . . . 0.0 111.113 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -59.66 -57.28 13.62 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 118.161 0.437 . . . . 0.0 111.132 174.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -50.52 13.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.776 0.83 . . . . 0.0 111.633 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.7 -25.89 20.48 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -61.8 -36.54 81.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.445 1.021 . . . . 0.0 110.869 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -73.85 -50.53 19.92 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 149.44 -46.58 0.65 Allowed Glycine 0 C--N 1.334 0.462 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -53.93 121.33 28.63 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.52 -11.26 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.744 1.63 . . . . 0.0 112.772 -174.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.33 37.51 0.69 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.168 0.894 . . . . 0.0 112.761 -172.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -153.26 130.9 11.51 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.848 -0.532 . . . . 0.0 111.49 175.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.7 mt -100.67 118.98 37.9 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.026 0.93 . . . . 0.0 110.459 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.6 m -68.68 157.33 36.48 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 166.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -40.71 2.38 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 173.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.6 -53.48 54.07 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.646 0.378 . . . . 0.0 111.294 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.77 -44.9 94.97 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.76 -47.72 81.69 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.294 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.14 -58.45 7.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.069 173.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.7 tp -49.52 -55.4 13.5 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 123.337 0.398 . . . . 0.0 111.661 -173.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.271 0.7 OUTLIER -72.21 -32.36 66.7 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.719 -174.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.06 -42.85 93.83 Favored 'General case' 0 CA--C 1.523 -0.079 0 CA-C-N 120.065 1.302 . . . . 0.0 109.943 174.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.28 -47.57 81.76 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.954 -0.699 . . . . 0.0 109.928 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.3 m -69.15 -50.5 47.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.606 -173.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -87.59 -38.2 16.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.562 -169.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -117.77 82.38 16.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -38.89 138.24 0.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 125.165 3.91 . . . . 0.0 113.507 169.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m 68.87 -46.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 126.31 1.844 . . . . 0.0 113.325 -175.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.11 -18.45 64.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.303 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.8 mp -14.53 -76.72 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 128.067 2.547 . . . . 0.0 110.879 166.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? 42.94 37.99 1.27 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.562 1.945 . . . . 0.0 113.118 168.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.94 -139.73 5.91 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 -172.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.0 tpp 50.63 -138.7 0.99 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.249 1.019 . . . . 0.0 109.791 -177.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -50.58 -49.09 57.23 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 119.307 0.958 . . . . 0.0 111.362 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -18.59 34.19 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.263 1.025 . . . . 0.0 113.065 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.28 -41.03 71.72 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.155 0.889 . . . . 0.0 109.6 171.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.79 -52.03 65.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.98 -57.0 14.45 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.45 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.22 -53.49 49.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.955 0.502 . . . . 0.0 110.047 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.52 -48.06 75.27 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.303 178.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.49 -42.25 95.94 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.106 0.412 . . . . 0.0 111.321 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.0 -48.19 59.14 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.553 0.692 . . . . 0.0 109.624 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.45 -57.27 10.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.379 1.472 . . . . 0.0 109.557 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -80.33 44.88 0.72 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.73 1.212 . . . . 0.0 112.475 -168.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -56.32 -48.51 76.56 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.071 0.949 . . . . 0.0 111.211 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -109.02 82.25 1.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.832 1.253 . . . . 0.0 108.429 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.47 -42.53 0.33 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 108.875 -1.69 . . . . 0.0 108.875 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 69.29 -59.74 0.48 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.622 2.369 . . . . 0.0 113.686 167.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -98.01 -27.77 8.65 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.846 1.213 . . . . 0.0 112.499 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -136.99 127.71 27.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.236 1.014 . . . . 0.0 109.173 -172.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.2 t -88.69 110.88 21.83 Favored 'Isoleucine or valine' 0 C--N 1.339 0.14 0 C-N-CA 123.903 0.881 . . . . 0.0 108.653 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.7 p -74.32 166.21 23.86 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.941 0.897 . . . . 0.0 110.242 171.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -56.81 -35.86 69.24 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.453 0.644 . . . . 0.0 110.173 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -61.18 -49.48 77.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.083 0.953 . . . . 0.0 110.179 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.33 -44.22 92.2 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.69 176.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -52.69 -40.9 63.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.665 0.786 . . . . 0.0 110.547 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -35.91 46.8 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.102 0.561 . . . . 0.0 112.173 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.16 -38.31 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 118.698 0.681 . . . . 0.0 110.227 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.63 -45.68 74.67 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.6 t -52.92 -42.2 42.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 O-C-N 121.646 -0.659 . . . . 0.0 111.393 177.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -53.82 -31.01 47.62 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.606 -0.684 . . . . 0.0 112.004 175.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -78.33 -51.64 9.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.909 0.484 . . . . 0.0 109.749 174.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.99 -34.73 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 118.212 0.46 . . . . 0.0 111.531 -176.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 m 74.81 -54.06 0.67 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.424 1.89 . . . . 0.0 112.431 171.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.035 -1.46 . . . . 0.0 111.99 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.57 -0.159 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -53.93 48.34 Favored Pre-proline 0 N--CA 1.45 -0.458 0 CA-C-O 117.858 -1.067 . . . . 0.0 112.298 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -47.5 -50.4 11.46 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.319 2.013 . . . . 0.0 112.449 177.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.98 -47.65 83.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.251 0.62 . . . . 0.0 110.826 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -56.41 -50.22 72.24 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.686 0.395 . . . . 0.0 110.094 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.14 -37.2 83.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.058 0.943 . . . . 0.0 109.853 -176.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -58.53 -54.12 50.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.831 0.452 . . . . 0.0 109.805 171.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.17 25.61 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -45.81 -62.81 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.401 1.48 . . . . 0.0 109.818 173.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -45.25 -57.51 3.93 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.49 1.116 . . . . 0.0 110.151 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.09 -48.15 79.3 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.238 -0.411 . . . . 0.0 112.086 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -62.81 -45.93 90.33 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.751 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -56.98 -53.31 59.45 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.732 0.696 . . . . 0.0 111.285 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -46.46 -59.47 2.95 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.319 1.048 . . . . 0.0 110.429 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.49 70.18 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -63.68 -40.88 97.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.452 0.569 . . . . 0.0 111.53 -173.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -134.2 7.87 3.69 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -170.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -162.33 -153.18 7.03 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 119.948 1.249 . . . . 0.0 112.039 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.42 139.0 85.18 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.216 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.1 -1.67 1.86 Allowed 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 123.491 2.794 . . . . 0.0 115.607 -173.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.56 33.13 0.95 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.74 1.154 . . . . 0.0 111.067 169.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -146.84 133.25 19.63 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.912 -0.492 . . . . 0.0 112.038 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 80.5 mt -96.7 109.34 22.0 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.753 0.821 . . . . 0.0 110.321 -175.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -59.07 164.26 3.12 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.179 0.9 . . . . 0.0 109.316 168.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -48.21 -33.83 9.2 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 169.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -63.23 -51.91 64.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.333 0.515 . . . . 0.0 109.616 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -57.9 -50.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.2 -45.67 87.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.065 -172.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -58.3 -56.07 26.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.775 -0.578 . . . . 0.0 109.854 171.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -52.4 -53.22 47.92 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.891 0.476 . . . . 0.0 111.523 -172.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.252 0.9 OUTLIER -73.14 -31.73 64.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.523 -176.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp -66.39 -42.05 88.48 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 120.886 1.675 . . . . 0.0 109.157 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -51.03 70.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 122.512 0.325 . . . . 0.0 111.643 172.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -70.66 -50.97 31.09 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 118.453 0.569 . . . . 0.0 110.144 -173.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -83.77 -37.61 22.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.841 0.856 . . . . 0.0 111.024 -169.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -128.09 62.92 60.17 Favored Pre-proline 0 C--O 1.235 0.293 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.861 -172.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -60.18 80.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.794 3.662 . . . . 0.0 111.661 -174.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.4 p 177.91 -49.5 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.52 2.328 . . . . 0.0 107.964 -169.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.3 mt -78.36 53.99 1.35 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.426 1.09 . . . . 0.0 111.583 -176.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.31 41.29 0.37 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.817 1.247 . . . . 0.0 109.572 175.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -67.63 76.16 0.18 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.808 1.243 . . . . 0.0 111.693 -176.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.63 134.74 8.55 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -61.38 -55.8 27.47 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -45.74 -46.93 15.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.942 1.297 . . . . 0.0 111.643 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.13 -28.14 4.07 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 126.372 1.869 . . . . 0.0 113.016 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 23.6 tp -53.4 -39.09 64.02 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.932 0.493 . . . . 0.0 110.198 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.15 -53.08 60.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.323 0.51 . . . . 0.0 110.02 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -66.1 -49.43 67.57 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.959 0.504 . . . . 0.0 109.732 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -54.27 -56.0 22.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -56.43 -46.29 80.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.724 0.809 . . . . 0.0 111.072 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -58.91 -41.45 87.29 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.149 0.431 . . . . 0.0 111.18 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -65.46 -43.36 90.58 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -73.48 -53.73 9.91 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.455 1.502 . . . . 0.0 111.555 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -81.02 51.95 1.67 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.899 1.28 . . . . 0.0 113.784 -167.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -34.75 -61.0 0.42 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 126.195 1.798 . . . . 0.0 113.301 -172.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.14 -41.15 7.25 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.985 0.914 . . . . 0.0 110.694 -173.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.0 -11.31 84.0 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 118.134 -1.37 . . . . 0.0 113.439 -171.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.3 t0 2.23 73.37 0.0 OUTLIER 'General case' 0 C--N 1.348 0.531 0 C-N-CA 129.221 3.008 . . . . 0.0 114.254 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.18 -49.29 0.55 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -169.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -145.62 137.93 25.63 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.093 0.557 . . . . 0.0 111.113 169.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 41.6 t -89.09 119.12 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 C-N-CA 126.635 1.974 . . . . 0.0 109.796 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.2 m -73.49 153.56 40.28 Favored 'General case' 0 C--O 1.228 -0.077 0 C-N-CA 124.967 1.307 . . . . 0.0 109.92 172.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -50.26 -39.96 46.59 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.158 0.504 . . . . 0.0 111.408 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -63.28 -36.41 83.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.399 0.68 . . . . 0.0 110.934 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.32 -44.34 52.92 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -52.42 -40.75 62.54 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 123.256 0.622 . . . . 0.0 110.313 175.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -54.82 -33.59 61.79 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.579 -0.701 . . . . 0.0 111.851 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.71 -42.8 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.375 -0.828 . . . . 0.0 109.322 173.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.46 -47.17 84.92 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 170.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.3 t -54.57 -42.41 59.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.362 0.983 . . . . 0.0 111.68 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.17 -41.84 68.96 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.24 -0.912 . . . . 0.0 110.583 173.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -73.66 -36.62 65.39 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.093 0.957 . . . . 0.0 112.824 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.53 -32.52 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 119.763 1.165 . . . . 0.0 110.034 174.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 m 63.18 43.3 6.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.969 1.708 . . . . 0.0 111.937 171.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 116.964 -1.494 . . . . 0.0 109.149 178.696 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.499 0.19 . . . . 0.0 110.786 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -46.96 -49.37 50.02 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-O 117.411 -1.28 . . . . 0.0 113.701 -169.034 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.56 -49.88 12.51 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.079 1.853 . . . . 0.0 112.944 176.109 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -75.54 -38.82 59.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.783 0.433 . . . . 0.0 110.559 -175.642 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -57.03 -53.21 60.67 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.62 0.724 . . . . 0.0 109.222 175.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.1 mt -61.49 -38.49 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.01 0.924 . . . . 0.0 109.739 178.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -57.98 -45.97 85.9 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 119.188 0.903 . . . . 0.0 111.229 172.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.01 -54.43 36.98 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 176.49 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.5 mt -51.91 -61.14 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 123.49 0.716 . . . . 0.0 109.452 178.026 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -43.42 -58.58 2.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.231 1.812 . . . . 0.0 109.981 177.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -55.94 -46.97 78.37 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.78 0.832 . . . . 0.0 111.292 -178.504 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -59.97 -47.48 85.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 119.32 -0.371 . . . . 0.0 111.203 179.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -61.76 -55.34 31.22 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.471 173.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.56 -51.55 2.93 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.354 1.862 . . . . 0.0 112.226 177.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -41.89 -43.07 2.93 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 175.65 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -60.43 -32.5 71.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 111.932 -179.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -59.48 -38.91 82.08 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.163 0.985 . . . . 0.0 110.054 174.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 -52.64 0.67 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.011 -2.035 . . . . 0.0 108.011 -169.132 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.34 119.64 44.62 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 172.029 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.88 -3.3 11.81 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.437 2.091 . . . . 0.0 113.684 -172.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.38 41.12 0.54 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.846 1.203 . . . . 0.0 111.482 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -148.06 129.03 14.44 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.916 -0.49 . . . . 0.0 111.263 174.716 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -94.86 112.12 23.86 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.318 1.047 . . . . 0.0 110.039 -175.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.9 t -73.14 168.32 19.33 Favored 'General case' 0 C--O 1.23 0.051 0 C-N-CA 117.791 -1.563 . . . . 0.0 108.965 167.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -38.82 -45.39 1.15 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.716 1.606 . . . . 0.0 111.992 178.595 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.15 -46.32 84.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -62.2 -50.08 73.23 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.325 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.01 -50.52 73.76 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -175.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -51.64 -57.15 9.99 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 176.218 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -44.75 95.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -168.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.8 tt -56.26 -57.31 12.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 175.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.04 -41.3 78.42 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 121.079 -1.013 . . . . 0.0 112.043 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.19 -49.92 72.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.557 1.071 . . . . 0.0 109.121 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 26.3 m -69.96 -51.12 35.22 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.417 -171.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -81.63 -39.08 24.99 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.774 0.83 . . . . 0.0 110.994 -172.578 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -127.93 65.84 69.73 Favored Pre-proline 0 C--O 1.235 0.327 0 CA-C-N 118.593 0.633 . . . . 0.0 110.66 -170.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.59 74.93 0.4 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.575 3.517 . . . . 0.0 111.287 -176.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.5 m -178.29 -43.43 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 129.564 3.146 . . . . 0.0 108.064 -174.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.45 58.85 2.25 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.488 0.715 . . . . 0.0 111.172 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.69 39.36 0.33 Allowed 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 125.535 1.534 . . . . 0.0 109.351 174.51 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -61.95 80.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.071 1.348 . . . . 0.0 111.058 -172.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.5 7.55 27.88 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.296 1.427 . . . . 0.0 113.246 178.068 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 26.6 ttt 61.35 -70.98 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.277 1.831 . . . . 0.0 113.126 175.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 10.0 m -53.04 -31.49 41.69 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.556 1.542 . . . . 0.0 111.675 179.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.2 -14.84 0.74 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.521 1.528 . . . . 0.0 113.089 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.5 tp -47.39 -40.46 17.73 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.187 0.903 . . . . 0.0 109.215 167.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -52.22 -54.84 26.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.01 0.368 . . . . 0.0 110.697 177.303 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -63.42 -50.01 71.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.497 0.719 . . . . 0.0 109.759 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 tp -55.63 -53.82 51.76 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.344 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -55.02 -46.25 75.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.914 0.485 . . . . 0.0 109.994 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.42 -45.71 80.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.202 0.455 . . . . 0.0 111.811 -179.183 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -77.01 -36.97 55.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 -176.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.08 -47.02 69.43 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.072 1.349 . . . . 0.0 110.182 -178.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.5 64.44 2.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.756 1.222 . . . . 0.0 110.719 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -75.84 70.91 2.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.043 1.337 . . . . 0.0 109.875 178.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 118.17 -140.74 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 130.124 3.37 . . . . 0.0 105.393 -171.536 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.28 -54.12 3.15 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 119.644 1.111 . . . . 0.0 114.067 169.066 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t0 67.07 65.79 0.43 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.767 2.027 . . . . 0.0 110.511 177.126 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.44 4.47 85.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.171 177.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -144.48 121.5 11.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.62 1.168 . . . . 0.0 109.195 178.133 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 115.85 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 125.145 1.378 . . . . 0.0 109.119 -176.204 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.7 p -73.74 163.05 28.49 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 124.109 0.964 . . . . 0.0 111.081 173.079 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.36 -41.03 68.67 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.64 0.376 . . . . 0.0 110.016 177.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -57.98 -51.33 70.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.716 0.806 . . . . 0.0 110.914 177.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.1 -44.76 96.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -52.11 -41.79 62.74 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.747 0.819 . . . . 0.0 111.317 177.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -52.79 -35.53 56.79 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.8 0.727 . . . . 0.0 112.009 176.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.0 t -57.62 -40.6 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 118.439 0.563 . . . . 0.0 110.104 175.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.0 tp -66.28 -45.65 79.73 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.824 -0.547 . . . . 0.0 109.624 172.292 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t -53.22 -42.28 46.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 118.347 0.521 . . . . 0.0 111.284 -178.032 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -52.22 -35.75 50.37 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.182 -0.324 . . . . 0.0 111.781 174.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -75.24 -54.7 6.66 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.706 0.403 . . . . 0.0 109.983 174.165 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 pt -56.09 -36.45 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 118.348 0.522 . . . . 0.0 111.355 -172.676 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.4 m 74.19 -49.44 0.67 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.826 1.651 . . . . 0.0 112.598 174.892 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 117.096 -1.43 . . . . 0.0 112.147 178.201 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.5 tttt . . . . . 0 N--CA 1.474 0.728 0 CA-C-O 120.459 0.171 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -55.01 33.33 Favored Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.437 -174.299 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.07 -50.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.519 2.146 . . . . 0.0 112.376 176.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.25 -44.67 94.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.136 0.574 . . . . 0.0 110.981 -179.233 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -57.69 -51.15 70.71 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.107 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.7 mt -62.38 -42.17 99.21 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.336 0.654 . . . . 0.0 109.761 -178.072 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -55.01 -51.05 67.47 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.371 0.532 . . . . 0.0 110.766 171.301 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -55.68 26.11 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.46 -59.15 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 C-N-CA 123.907 0.883 . . . . 0.0 109.288 176.43 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -47.28 -55.18 9.19 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.911 1.284 . . . . 0.0 109.741 -179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -57.57 -47.45 82.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.59 0.756 . . . . 0.0 111.076 -176.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.83 -48.85 79.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.775 -178.465 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -57.04 -59.68 4.71 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.348 0.594 . . . . 0.0 111.064 174.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.9 -51.46 13.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.889 2.076 . . . . 0.0 112.154 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.29 17.78 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.631 0.772 . . . . 0.0 112.401 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -31.74 67.96 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.983 -0.532 . . . . 0.0 111.929 -178.489 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -159.3 81.2 0.76 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.808 0.813 . . . . 0.0 111.385 -169.459 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 147.87 -83.75 0.18 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 107.362 -2.295 . . . . 0.0 107.362 173.336 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -163.47 156.75 16.34 Favored Pre-proline 0 C--N 1.33 -0.248 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 174.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -45.81 -29.22 5.47 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 CA-C-N 122.075 1.777 . . . . 0.0 114.001 169.828 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -96.29 7.46 46.41 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.37 -1.3 . . . . 0.0 114.443 177.833 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -156.79 132.49 9.47 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -168.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.8 117.03 32.97 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.865 2.066 . . . . 0.0 111.412 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.3 m -65.49 159.49 24.31 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.022 1.283 . . . . 0.0 111.02 169.094 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 59.3 mtmt -37.99 -53.27 1.37 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.341 1.456 . . . . 0.0 112.867 177.263 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mp0 -65.71 -31.45 72.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 119.5 -0.286 . . . . 0.0 110.406 -175.821 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -73.77 -43.53 58.73 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.66 -45.96 77.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.566 0.746 . . . . 0.0 109.358 173.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -60.47 -49.05 79.09 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 121.407 -0.808 . . . . 0.0 110.685 173.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.99 -60.8 2.47 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 123.548 0.739 . . . . 0.0 111.164 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.251 1.4 pt? -70.94 -33.61 70.66 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.384 -172.123 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -65.43 -42.63 92.26 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.344 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -58.24 -50.34 73.92 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.919 1.236 . . . . 0.0 110.856 173.061 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -62.2 -56.71 15.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 110.498 -173.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -84.25 -35.48 23.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.336 1.054 . . . . 0.0 111.604 -170.0 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -134.13 62.45 56.72 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.84 0.856 . . . . 0.0 112.028 -169.881 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -64.97 83.11 0.18 Allowed 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 123.78 2.987 . . . . 0.0 111.556 -174.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.0 p 154.55 -28.81 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 129.149 2.979 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 tp -64.2 -35.99 82.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.905 0.775 . . . . 0.0 110.833 -177.57 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.67 -19.34 65.67 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 170.667 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 66.83 -59.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.267 2.227 . . . . 0.0 113.253 179.192 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.71 168.41 41.05 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 47.4 tpp -56.77 -66.61 0.42 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.579 0.752 . . . . 0.0 110.226 -173.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.9 m -51.04 -44.94 61.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.702 0.801 . . . . 0.0 110.789 177.316 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -25.71 21.76 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.289 1.436 . . . . 0.0 112.647 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.5 tp -53.37 -43.06 67.49 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.43 0.559 . . . . 0.0 109.6 174.04 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -55.97 -51.15 68.72 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -178.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.53 -54.83 33.97 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.168 0.587 . . . . 0.0 109.731 -178.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.4 tp -51.43 -58.15 7.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.425 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 27.1 t80 -54.86 -43.98 73.57 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.23 1.012 . . . . 0.0 111.214 -179.204 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -57.59 -44.57 85.47 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.199 0.454 . . . . 0.0 111.048 179.537 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -72.02 -43.9 64.28 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 -179.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -62.04 -59.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.427 1.491 . . . . 0.0 110.253 -176.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -78.28 65.28 3.59 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -178.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -59.5 -29.85 68.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.324 0.65 . . . . 0.0 111.483 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.65 -25.61 67.48 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.646 0.778 . . . . 0.0 111.984 172.276 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.75 35.96 92.7 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 124.377 0.989 . . . . 0.0 111.881 177.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -79.39 -10.34 59.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 117.133 0.467 . . . . 0.0 111.44 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.39 8.48 83.3 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -175.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -164.92 134.38 3.62 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -173.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.8 t -88.58 103.73 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 126.623 1.969 . . . . 0.0 108.776 -168.085 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.61 152.82 37.81 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.634 1.174 . . . . 0.0 109.193 175.089 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -51.01 -33.79 26.46 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.74 0.7 . . . . 0.0 111.731 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -55.59 -53.13 60.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.189 0.996 . . . . 0.0 110.584 173.106 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -62.57 -43.28 99.2 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -58.43 -44.65 89.22 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 122.048 -0.407 . . . . 0.0 111.028 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -57.96 -37.48 74.26 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.193 -0.942 . . . . 0.0 111.635 176.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.53 -38.99 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.439 -0.788 . . . . 0.0 109.802 172.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -50.93 68.97 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.652 -0.655 . . . . 0.0 109.75 169.443 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t -55.67 -39.64 56.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.549 0.74 . . . . 0.0 110.801 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -53.56 -33.94 56.5 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.828 -0.545 . . . . 0.0 111.216 174.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -76.12 -52.88 9.19 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.785 0.434 . . . . 0.0 110.005 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -32.25 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.89 -0.506 . . . . 0.0 111.589 -175.726 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.0 m 85.16 -42.14 0.06 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 127.686 2.394 . . . . 0.0 112.512 170.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 116.97 -1.491 . . . . 0.0 111.493 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.416 0.151 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -51.11 55.9 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.825 -174.826 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.36 -43.93 46.46 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.356 2.038 . . . . 0.0 112.439 176.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.26 -43.75 73.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.189 0.596 . . . . 0.0 109.925 -177.682 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -56.73 -52.26 65.67 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.7 mt -60.48 -42.12 95.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.992 0.517 . . . . 0.0 109.87 -178.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -56.08 -51.51 67.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.293 0.497 . . . . 0.0 110.627 172.534 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.92 37.96 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -50.36 -60.9 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 123.63 0.772 . . . . 0.0 109.047 175.196 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.4 -57.11 4.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.07 1.348 . . . . 0.0 110.576 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.27 -47.86 77.76 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 111.765 179.676 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -59.08 -44.25 91.87 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.997 -0.439 . . . . 0.0 111.784 179.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -63.91 -56.26 16.62 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.808 0.731 . . . . 0.0 111.381 173.125 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.97 -46.25 2.77 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.229 1.812 . . . . 0.0 112.68 178.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -42.11 -35.76 1.0 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 174.541 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -63.77 -27.94 69.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 111.349 178.754 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.23 5.81 4.14 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.161 1.384 . . . . 0.0 111.498 170.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.48 -62.89 3.75 Favored Glycine 0 CA--C 1.527 0.836 0 O-C-N 120.223 -1.548 . . . . 0.0 109.536 -172.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.48 113.7 8.88 Favored Pre-proline 0 CA--C 1.535 0.387 0 C-N-CA 123.064 0.546 . . . . 0.0 109.917 177.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -79.97 35.81 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.589 2.193 . . . . 0.0 111.94 -173.544 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -159.89 22.19 0.17 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 177.806 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -151.69 135.67 16.52 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.173 0.589 . . . . 0.0 109.769 -177.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 70.3 mt -111.5 123.01 49.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.15 1.38 . . . . 0.0 109.891 -175.099 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -84.44 168.96 15.03 Favored 'General case' 0 C--N 1.335 -0.058 0 CA-C-N 120.431 1.468 . . . . 0.0 109.476 168.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -38.48 -47.84 1.32 Allowed 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 126.152 1.781 . . . . 0.0 110.743 178.365 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -51.69 -55.44 19.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.296 0.638 . . . . 0.0 111.513 176.145 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -62.43 -44.77 95.64 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.26 -47.67 84.47 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.765 -0.159 . . . . 0.0 110.86 -173.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -55.36 -55.45 31.38 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 121.211 -0.931 . . . . 0.0 109.531 173.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 tp -51.84 -55.32 20.72 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.718 1.261 . . . . 0.0 110.416 -172.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 0.8 OUTLIER -75.35 -32.82 61.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 118.539 -0.743 . . . . 0.0 111.793 -175.487 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.16 -44.25 76.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 120.266 1.394 . . . . 0.0 110.854 178.898 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -51.59 68.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.109 174.6 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 51.5 m -66.3 -52.51 46.57 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 121.163 -0.215 . . . . 0.0 111.279 -171.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.581 0.752 . . . . 0.0 111.347 -170.772 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -125.05 56.33 13.22 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -169.492 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -40.0 141.88 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.751 2.968 . . . . 0.0 113.515 173.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.8 m 73.5 -38.24 0.4 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.337 1.455 . . . . 0.0 113.332 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.73 62.03 1.04 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.605 1.093 . . . . 0.0 110.135 176.204 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 174.18 -12.06 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.242 3.417 . . . . 0.0 111.421 -177.387 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 70.44 -64.13 0.38 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 126.327 1.851 . . . . 0.0 110.668 -178.565 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 173.64 122.23 0.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.964 -0.855 . . . . 0.0 110.964 177.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.4 mpt? 26.46 -92.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 128.448 2.699 . . . . 0.0 114.054 169.129 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.7 m -44.69 -42.13 7.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.065 1.746 . . . . 0.0 113.056 -177.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.5 m -54.67 -30.34 55.21 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.052 0.941 . . . . 0.0 111.48 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.84 -33.94 69.17 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.561 176.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.24 -43.38 74.54 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.243 0.929 . . . . 0.0 110.422 178.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.95 -58.68 4.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.298 0.639 . . . . 0.0 109.472 175.157 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -50.15 -50.03 50.26 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.851 0.86 . . . . 0.0 110.628 -174.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -51.32 -39.8 57.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.847 1.659 . . . . 0.0 111.053 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -61.32 -35.26 76.91 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 117.908 0.322 . . . . 0.0 110.727 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.19 -44.94 18.92 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.17 -56.52 20.72 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.022 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -79.86 65.73 5.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.711 0.804 . . . . 0.0 109.87 -172.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -54.87 -29.49 55.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.078 0.951 . . . . 0.0 112.018 176.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.03 -24.99 66.06 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.835 0.454 . . . . 0.0 112.148 176.04 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.17 74.35 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 123.451 0.548 . . . . 0.0 111.966 -178.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -76.49 -18.04 58.96 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.467 0.634 . . . . 0.0 111.717 179.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 18.03 79.3 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 108.254 -1.939 . . . . 0.0 108.254 -165.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -157.98 154.03 27.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 126.901 2.081 . . . . 0.0 107.745 -169.508 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.7 t -117.98 112.92 40.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 125.681 1.592 . . . . 0.0 108.037 -172.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.6 p -67.52 162.55 23.05 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 123.185 0.594 . . . . 0.0 110.611 175.556 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -54.34 -37.45 64.92 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.608 0.718 . . . . 0.0 110.478 169.592 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -59.46 -56.79 17.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.933 0.893 . . . . 0.0 110.084 177.542 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -59.93 -42.01 93.04 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.433 0.635 . . . . 0.0 110.046 179.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -54.74 -47.73 73.46 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 177.114 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.64 -28.27 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.602 -0.686 . . . . 0.0 112.408 178.09 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.4 t -64.24 -50.97 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 169.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.43 -39.18 69.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.175 -0.328 . . . . 0.0 111.539 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.0 t -44.8 -38.85 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 124.529 1.132 . . . . 0.0 111.825 175.252 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -59.79 -35.06 73.89 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.066 -0.396 . . . . 0.0 111.432 -179.497 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -79.05 -47.06 16.87 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 172.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.14 -39.44 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 124.955 1.302 . . . . 0.0 110.945 -177.333 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m 72.55 -52.52 0.7 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.934 1.694 . . . . 0.0 112.586 176.266 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.616 -1.183 . . . . 0.0 110.16 174.431 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.3 -48.0 86.95 Favored Pre-proline 0 CA--C 1.538 0.49 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.209 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.13 -43.09 61.52 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.122 1.881 . . . . 0.0 112.231 174.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.85 -40.69 83.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.351 0.661 . . . . 0.0 109.669 -178.727 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.68 -53.02 61.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.526 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.19 -37.69 86.27 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.437 -178.96 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -56.42 -50.71 70.84 Favored 'General case' 0 CA--C 1.527 0.07 0 CA-C-N 118.681 0.673 . . . . 0.0 110.296 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.69 -52.85 45.65 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 178.418 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 53.8 mt -52.78 -60.1 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.721 0.808 . . . . 0.0 109.362 177.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -46.86 -54.35 10.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.699 1.2 . . . . 0.0 109.863 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.13 -51.36 69.6 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.158 0.983 . . . . 0.0 110.679 -178.109 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -58.33 -47.66 83.05 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.913 -0.492 . . . . 0.0 111.557 -179.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -54.0 -62.17 1.83 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.33 0.586 . . . . 0.0 110.967 171.468 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.54 -45.0 46.95 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.335 -174.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.68 -30.82 14.64 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.692 0.797 . . . . 0.0 112.486 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -80.44 -85.54 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 118.111 0.414 . . . . 0.0 110.58 176.09 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -97.57 70.24 2.23 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.37 -0.831 . . . . 0.0 110.037 -168.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.22 -75.33 0.11 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 170.654 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -178.75 147.23 0.53 Allowed Pre-proline 0 C--N 1.332 -0.173 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -169.692 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -24.6 -50.39 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 1 C-N-CA 125.426 4.084 . . . . 0.0 115.64 172.752 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -134.18 48.74 2.31 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 173.688 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -146.5 134.94 21.96 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.915 -0.49 . . . . 0.0 111.684 168.519 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.1 mt -101.88 124.97 48.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.58 1.152 . . . . 0.0 111.111 -176.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 86.5 p -63.55 164.47 9.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.358 0.981 . . . . 0.0 108.982 167.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.9 ptpp? -52.32 -38.28 58.13 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.078 -1.014 . . . . 0.0 112.473 169.337 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.39 -49.92 74.95 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.371 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -63.15 -41.92 99.35 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 122.218 -0.302 . . . . 0.0 111.242 178.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.94 -43.61 94.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.33 1.052 . . . . 0.0 109.154 178.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -55.91 -58.53 7.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.27 -60.45 2.12 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.353 1.061 . . . . 0.0 111.561 -173.192 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -67.35 -33.12 74.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.775 -174.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.88 -37.43 86.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.073 174.142 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -63.21 -48.99 75.97 Favored 'General case' 0 CA--C 1.527 0.067 0 CA-C-N 120.206 1.366 . . . . 0.0 109.25 176.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -63.76 -55.57 22.14 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.037 -173.343 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -86.43 -36.08 19.31 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.995 0.918 . . . . 0.0 111.787 -169.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -131.95 60.04 48.73 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 123.756 0.822 . . . . 0.0 112.213 -169.233 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -59.54 157.42 31.89 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.122 1.881 . . . . 0.0 110.147 177.444 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.8 m 70.07 -37.06 0.37 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.308 1.443 . . . . 0.0 113.941 -177.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.8 tt -52.27 -40.44 61.76 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.53 1.059 . . . . 0.0 110.932 177.233 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -14.29 53.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 176.864 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.0 tptt 64.4 -64.22 0.15 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 127.233 2.213 . . . . 0.0 113.145 -178.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.61 147.82 11.76 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.751 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 53.7 ttm -32.7 -61.76 0.26 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.75 2.02 . . . . 0.0 113.463 -171.086 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -45.99 -41.09 11.35 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.177 1.391 . . . . 0.0 112.784 -177.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.9 m -55.41 -25.94 38.78 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.072 0.949 . . . . 0.0 111.441 -178.062 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 tp -52.29 -38.57 58.76 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 123.066 0.546 . . . . 0.0 110.403 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -57.21 -54.05 51.14 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.057 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.7 -55.61 18.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.002 -177.21 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tt -49.65 -56.09 11.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.623 1.169 . . . . 0.0 109.678 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -58.45 -46.45 86.54 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.197 -0.43 . . . . 0.0 110.76 179.274 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -42.7 89.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.589 0.632 . . . . 0.0 111.316 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -70.12 -50.16 43.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.685 0.755 . . . . 0.0 109.611 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.45 -55.05 39.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.471 1.508 . . . . 0.0 109.603 -178.018 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -80.64 46.35 0.86 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.071 1.348 . . . . 0.0 112.245 -169.362 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -44.89 -41.32 7.04 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.68 1.992 . . . . 0.0 114.048 -171.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -103.21 -45.18 4.98 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.884 0.874 . . . . 0.0 110.822 -177.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.09 -4.98 88.0 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 117.829 -1.54 . . . . 0.0 114.166 -169.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -2.39 76.86 0.0 OUTLIER 'General case' 0 C--N 1.348 0.512 0 C-N-CA 129.018 2.927 . . . . 0.0 114.254 178.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.15 -47.56 0.63 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -169.328 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -138.99 127.01 22.38 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.499 1.119 . . . . 0.0 110.14 179.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 32.9 t -88.48 117.82 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 124.746 1.218 . . . . 0.0 110.345 -177.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.2 m -80.89 155.77 26.37 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.54 1.136 . . . . 0.0 110.849 172.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -55.54 -33.38 63.77 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.077 0.465 . . . . 0.0 112.091 -178.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.55 -47.5 69.96 Favored 'General case' 0 C--O 1.227 -0.092 0 O-C-N 121.592 -0.693 . . . . 0.0 110.714 172.26 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -72.79 -41.26 65.19 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -53.7 -43.92 69.37 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.981 -0.449 . . . . 0.0 110.494 177.827 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -57.4 -30.79 65.23 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.745 -0.597 . . . . 0.0 112.571 177.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.6 t -61.17 -39.83 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.245 0.93 . . . . 0.0 109.63 171.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -46.87 84.52 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.312 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.7 t -54.83 -38.16 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.339 -0.851 . . . . 0.0 111.659 177.812 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -57.76 -39.23 76.93 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.687 -0.633 . . . . 0.0 110.575 173.403 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -71.95 -52.01 19.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.028 0.531 . . . . 0.0 110.471 177.484 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -53.81 -29.75 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.75 0.704 . . . . 0.0 110.574 176.09 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.8 m 77.62 42.98 0.11 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 127.157 2.183 . . . . 0.0 108.584 177.822 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.857 1.663 . . . . 0.0 112.892 177.549 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 118.006 -0.997 . . . . 0.0 112.934 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.54 -48.04 22.11 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.975 1.783 . . . . 0.0 111.965 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.02 -47.65 76.7 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 123.328 0.651 . . . . 0.0 110.08 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -56.72 -50.19 72.94 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 mt -67.05 -37.01 83.29 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.225 0.61 . . . . 0.0 109.752 -175.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -60.32 -47.74 84.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.294 0.497 . . . . 0.0 110.525 172.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -56.18 -55.63 28.4 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -47.65 -63.92 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.657 1.183 . . . . 0.0 109.15 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -43.38 -55.73 3.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.503 1.521 . . . . 0.0 110.777 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.73 -48.59 79.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.956 0.903 . . . . 0.0 110.682 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -60.02 -47.4 86.0 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.048 -0.408 . . . . 0.0 111.009 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.36 -55.89 28.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.211 0.459 . . . . 0.0 110.977 174.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.88 -53.25 6.23 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.391 1.076 . . . . 0.0 112.013 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 178.231 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 mt -111.95 110.13 20.28 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.049 1.34 . . . . 0.0 111.01 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 m -62.84 159.96 15.55 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.411 -0.805 . . . . 0.0 109.42 167.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 1.2 mptp? -38.61 -50.56 1.61 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 124.305 1.042 . . . . 0.0 112.849 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.62 -41.15 98.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.469 0.176 . . . . 0.0 111.329 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -68.54 -44.79 73.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.88 -52.89 63.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -50.47 -56.27 12.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.153 0.581 . . . . 0.0 109.848 175.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -58.65 -45.91 88.27 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.867 1.267 . . . . 0.0 109.014 -169.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.597 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.2 tt -59.02 -55.45 34.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.79 -37.2 70.8 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.114 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.8 -51.85 66.59 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 119.285 0.948 . . . . 0.0 109.125 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -66.91 -51.76 51.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.416 -172.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -77.86 -40.56 39.74 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.541 0.737 . . . . 0.0 111.629 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 123.765 0.826 . . . . 0.0 112.859 -169.435 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.4 tp . . . . . 0 C--O 1.224 -0.271 0 CA-C-O 119.62 -0.229 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -55.92 -55.39 33.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.174 0.511 . . . . 0.0 110.356 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.09 -50.72 63.09 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.11 -57.09 12.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.827 0.851 . . . . 0.0 109.162 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.476 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.6 t80 -59.69 -43.52 94.03 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 118.072 0.396 . . . . 0.0 110.558 -179.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.97 -43.7 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.12 0.418 . . . . 0.0 111.1 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.71 -53.57 13.09 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.39 0.614 . . . . 0.0 109.548 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.26 -59.71 4.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.103 2.161 . . . . 0.0 109.738 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -81.08 45.15 0.81 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.527 0.731 . . . . 0.0 112.401 -169.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 124.068 0.947 . . . . 0.0 111.688 -169.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.773 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -127.21 139.27 53.05 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.388 1.475 . . . . 0.0 109.261 -172.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.93 111.02 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 124.943 1.297 . . . . 0.0 107.784 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -75.95 166.54 23.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -57.34 -32.22 66.51 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.32 0.581 . . . . 0.0 110.956 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -53.94 -55.49 26.57 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.866 0.866 . . . . 0.0 110.244 172.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -65.99 -41.27 91.3 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -56.01 -43.18 77.47 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.808 -0.557 . . . . 0.0 111.204 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -56.18 -30.21 61.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.531 -0.731 . . . . 0.0 112.039 176.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.8 -42.63 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.336 0.971 . . . . 0.0 110.283 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.65 -47.01 88.15 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 53.7 t . . . . . 0 CA--C 1.534 0.347 0 O-C-N 121.546 -0.721 . . . . 0.0 111.499 177.716 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 N--CA 1.451 -0.386 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.87 -48.04 23.48 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.817 1.678 . . . . 0.0 111.976 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.5 mp0 -65.73 -46.6 78.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.487 0.715 . . . . 0.0 110.141 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -57.8 -49.0 78.11 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mp -67.84 -33.01 73.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.523 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.25 -50.29 74.25 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.093 0.86 . . . . 0.0 110.175 169.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.97 -56.96 18.3 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.504 -1.039 . . . . 0.0 110.504 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.9 mt -44.16 -64.98 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.783 1.633 . . . . 0.0 110.01 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -43.14 -54.34 4.49 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.687 1.195 . . . . 0.0 109.662 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -59.1 -53.51 57.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.904 0.882 . . . . 0.0 111.448 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -63.65 -33.2 75.11 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 119.935 -0.706 . . . . 0.0 112.033 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -65.79 -60.62 2.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.853 0.752 . . . . 0.0 110.972 170.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' N ' ' A' ' 22' ' ' GLN . . . -43.9 -41.02 4.92 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 125.614 1.565 . . . . 0.0 112.747 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 174.57 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.401 ' N ' ' HB1' ' A' ' 14' ' ' ALA . 2.0 tt0 . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.5 mt -115.94 107.77 15.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.894 0.878 . . . . 0.0 109.949 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.6 t -72.82 166.15 23.49 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 120.113 1.324 . . . . 0.0 109.718 169.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -38.78 -45.75 1.18 Allowed 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.742 1.617 . . . . 0.0 112.168 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.48 -48.54 81.24 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.056 0.389 . . . . 0.0 111.401 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.97 -40.95 75.08 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.24 -47.57 85.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.528 1.131 . . . . 0.0 108.993 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -59.2 -48.73 80.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.123 -0.985 . . . . 0.0 110.573 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.8 tp -52.36 -58.66 5.99 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 121.965 -0.46 . . . . 0.0 110.954 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.261 1.2 pt? -71.8 -33.86 68.91 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.12 -175.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.05 -42.79 93.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.169 1.35 . . . . 0.0 110.325 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -56.27 -53.82 52.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 119.499 1.045 . . . . 0.0 110.695 170.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -64.28 -51.52 63.09 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.413 -170.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -81.33 -40.15 24.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.165 0.986 . . . . 0.0 111.526 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 124.213 1.005 . . . . 0.0 111.631 -170.539 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--O 1.222 -0.349 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -56.96 -49.92 74.23 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 110.783 176.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -62.82 -55.09 29.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.331 0.586 . . . . 0.0 109.988 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.0 tp -48.95 -53.24 20.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.41 1.084 . . . . 0.0 109.361 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.36 -47.18 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.03 0.932 . . . . 0.0 110.659 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -55.96 -45.1 78.98 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.129 0.422 . . . . 0.0 110.922 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.27 -41.52 80.95 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.168 0.587 . . . . 0.0 110.851 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.48 -56.56 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 127.251 2.22 . . . . 0.0 109.51 -174.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.63 51.0 1.4 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.674 1.59 . . . . 0.0 111.832 -169.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.4 mttp . . . . . 0 CA--C 1.533 0.298 0 C-N-CA 124.617 1.167 . . . . 0.0 113.049 -169.703 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.64 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -137.44 132.13 32.95 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.068 0.947 . . . . 0.0 110.266 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.0 t -87.93 114.36 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 125.676 1.59 . . . . 0.0 109.167 -175.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.5 m -79.3 159.84 27.05 Favored 'General case' 0 C--N 1.335 -0.063 0 C-N-CA 123.823 0.849 . . . . 0.0 110.819 174.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -53.12 -33.79 53.86 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.478 0.656 . . . . 0.0 111.646 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 mp0 -56.26 -47.35 78.75 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.006 0.922 . . . . 0.0 110.144 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -75.67 -36.08 60.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -58.45 -42.38 87.25 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.61 -0.681 . . . . 0.0 110.33 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -57.15 -33.97 67.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.61 -1.306 . . . . 0.0 111.898 172.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.8 t -63.24 -45.73 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.402 1.001 . . . . 0.0 109.463 171.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.5 tp -51.3 -45.35 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.498 0.59 . . . . 0.0 110.42 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 CA--C 1.536 0.411 0 CA-C-N 118.845 0.748 . . . . 0.0 111.227 179.068 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.09 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -52.2 -46.17 34.49 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.088 1.859 . . . . 0.0 111.861 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.02 -44.87 79.19 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.764 0.826 . . . . 0.0 110.031 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.13 -50.88 71.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -65.27 -38.56 90.67 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.269 0.628 . . . . 0.0 110.106 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -56.32 -54.51 44.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 170.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.9 -55.09 22.56 Favored Glycine 0 CA--C 1.529 0.908 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.46 -61.5 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.342 1.057 . . . . 0.0 109.521 175.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -45.16 -53.6 7.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.395 1.078 . . . . 0.0 110.654 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -60.85 -48.39 82.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.338 0.655 . . . . 0.0 110.539 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.53 -44.72 93.12 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.893 0.315 . . . . 0.0 111.04 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -58.29 -62.48 1.8 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.758 0.254 . . . . 0.0 110.829 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.48 -52.24 6.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.154 1.382 . . . . 0.0 112.092 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 114.245 -177.551 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.185 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -119.11 116.64 26.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.983 1.713 . . . . 0.0 109.978 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 95.7 p -63.11 169.52 3.38 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.024 -1.047 . . . . 0.0 110.204 169.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -45.73 -43.2 12.68 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.37 -0.832 . . . . 0.0 111.365 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.18 -47.69 73.14 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.226 -0.296 . . . . 0.0 110.412 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.94 -41.74 99.59 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.853 -0.529 . . . . 0.0 109.977 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.5 -49.74 76.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.571 1.548 . . . . 0.0 110.129 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -62.38 -40.77 97.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.121 175.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.9 -57.2 13.55 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 121.531 -0.731 . . . . 0.0 111.098 -178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.4 pt? -69.4 -35.79 76.12 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 119.229 -0.988 . . . . 0.0 112.113 -176.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.86 -40.73 95.6 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 119.453 1.024 . . . . 0.0 110.676 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -57.21 -52.19 66.33 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.468 1.031 . . . . 0.0 110.954 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -61.25 -56.05 25.02 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 110.698 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -83.31 -36.6 24.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.502 1.121 . . . . 0.0 111.799 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 . . . . . 0 CA--C 1.536 0.414 0 C-N-CA 123.678 0.791 . . . . 0.0 112.247 -172.443 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.224 -0.283 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.23 -50.67 68.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.597 0.359 . . . . 0.0 110.414 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.3 mp0 -66.69 -50.24 63.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.3 tt -50.57 -57.98 6.89 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -52.65 -50.73 62.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.258 1.023 . . . . 0.0 110.928 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -54.53 -42.44 70.89 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.848 0.749 . . . . 0.0 111.611 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -72.04 -20.04 61.74 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.52 0.328 . . . . 0.0 111.607 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -90.75 -58.59 2.43 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.922 1.289 . . . . 0.0 110.206 -176.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -78.81 43.32 0.49 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.513 1.925 . . . . 0.0 113.311 -167.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 CA--C 1.535 0.404 0 C-N-CA 124.178 0.991 . . . . 0.0 111.852 -169.976 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.87 0 CA-C-O 119.419 -0.656 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -138.11 138.49 38.75 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.778 0.831 . . . . 0.0 110.222 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.7 t -88.72 116.61 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 C-N-CA 127.106 2.162 . . . . 0.0 109.826 -172.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.9 p -70.13 168.32 15.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.742 0.817 . . . . 0.0 111.471 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -60.92 -35.56 77.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.596 0.713 . . . . 0.0 109.676 169.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -58.9 -51.99 67.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.005 0.922 . . . . 0.0 109.094 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -65.98 -40.18 91.01 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.359 0.599 . . . . 0.0 110.247 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -60.4 -34.0 73.29 Favored 'General case' 0 C--O 1.216 -0.697 0 O-C-N 121.375 -0.828 . . . . 0.0 111.479 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.6 -35.06 73.58 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.03 -1.669 . . . . 0.0 111.703 170.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.5 t -62.75 -42.39 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 121.038 -1.039 . . . . 0.0 108.739 169.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.51 -43.49 68.34 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.403 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 CA--C 1.534 0.33 0 CA-C-N 120.139 1.336 . . . . 0.0 110.289 177.76 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 118.231 -0.89 . . . . 0.0 113.221 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.68 -47.81 19.65 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 121.783 1.656 . . . . 0.0 112.323 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -69.62 -43.33 72.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.862 0.465 . . . . 0.0 110.332 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -54.69 -54.46 41.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.086 0.47 . . . . 0.0 109.775 177.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.07 -34.46 76.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.621 -177.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -57.78 -50.12 74.31 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 119.67 1.123 . . . . 0.0 110.558 172.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.23 -53.84 41.67 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 23.4 mt -49.45 -62.27 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -45.99 -57.18 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.007 1.323 . . . . 0.0 111.165 -177.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -66.13 -36.2 82.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.326 -0.369 . . . . 0.0 111.215 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -63.5 -49.21 74.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.672 0.669 . . . . 0.0 110.005 176.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -57.8 -52.65 64.58 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.717 -0.615 . . . . 0.0 111.363 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.61 -57.74 3.95 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.031 0.532 . . . . 0.0 110.626 172.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 123.23 0.612 . . . . 0.0 112.626 177.077 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 CA--C 1.536 0.414 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.6 mt -109.2 108.93 19.74 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.809 1.244 . . . . 0.0 110.532 -173.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.4 t -70.79 165.8 22.35 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 119.43 1.014 . . . . 0.0 110.698 169.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 59.3 mtmt -38.24 -51.22 1.47 Allowed 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 126.222 1.809 . . . . 0.0 112.378 -176.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.0 mp0 -65.41 -39.44 92.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.77 -0.157 . . . . 0.0 110.709 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.74 -42.0 74.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.53 -48.68 80.06 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.574 -0.158 . . . . 0.0 110.574 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.85 -52.17 66.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.301 -0.874 . . . . 0.0 109.433 177.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 tp -51.28 -60.34 3.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 123.349 0.406 . . . . 0.0 110.363 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.281 0.9 OUTLIER -69.94 -32.33 70.54 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 119.126 -1.03 . . . . 0.0 112.467 -173.435 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.81 -44.95 84.1 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 119.962 1.255 . . . . 0.0 110.48 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -48.53 80.46 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.99 0.359 . . . . 0.0 110.289 176.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -64.81 -53.47 46.4 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.428 0.156 . . . . 0.0 110.695 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -83.8 -41.21 17.8 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.237 0.615 . . . . 0.0 111.432 -171.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 CA--C 1.541 0.606 0 CA-C-N 118.55 0.614 . . . . 0.0 111.962 -174.073 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.0 tp . . . . . 0 C--O 1.222 -0.38 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.36 -53.55 52.44 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 118.258 0.481 . . . . 0.0 110.562 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.17 -49.6 64.12 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -55.61 -52.68 62.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 19.1 t80 -57.78 -44.71 86.4 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.533 0.733 . . . . 0.0 110.419 178.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.35 -41.07 88.37 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.069 0.395 . . . . 0.0 111.149 178.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -68.85 -46.6 68.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.671 0.748 . . . . 0.0 109.272 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.77 -54.77 8.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.324 1.45 . . . . 0.0 110.672 -170.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.55 48.23 1.03 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.514 1.126 . . . . 0.0 112.886 -168.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.2 mttp . . . . . 0 CA--C 1.532 0.274 0 C-N-CA 125.429 1.491 . . . . 0.0 112.694 -169.845 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.687 0 N-CA-C 108.431 -1.867 . . . . 0.0 108.431 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -151.77 135.72 16.49 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 112.11 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.2 t -88.08 116.13 29.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 127.269 2.228 . . . . 0.0 110.335 -168.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 89.4 p -67.59 164.69 18.54 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.151 0.98 . . . . 0.0 111.075 175.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -58.92 -37.67 77.19 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.22 0.533 . . . . 0.0 110.368 170.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -56.52 -54.82 41.41 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.193 0.597 . . . . 0.0 110.26 175.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -61.49 -43.43 98.88 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.035 0.445 . . . . 0.0 110.013 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.49 -41.74 77.15 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 122.058 -0.401 . . . . 0.0 111.002 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -58.31 -27.6 64.24 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.119 -0.988 . . . . 0.0 112.345 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.72 -43.02 97.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.633 1.106 . . . . 0.0 109.497 170.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -58.99 -46.75 87.39 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 172.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 CA--C 1.535 0.391 0 O-C-N 120.998 -1.064 . . . . 0.0 111.176 175.361 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 118.35 -0.833 . . . . 0.0 112.642 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -56.59 -37.33 97.76 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 CA-C-N 120.881 1.35 . . . . 0.0 111.241 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -64.86 -51.54 61.46 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 122.654 0.381 . . . . 0.0 110.904 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -65.66 -38.89 90.59 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.451 -0.781 . . . . 0.0 109.11 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.13 -30.73 71.28 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.254 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -59.32 -46.51 88.38 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 120.346 1.43 . . . . 0.0 109.321 169.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.97 -56.8 16.94 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.5 mt -50.02 -63.18 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 123.391 0.676 . . . . 0.0 109.637 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -43.01 -52.79 5.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.423 1.889 . . . . 0.0 110.675 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.4 -50.57 73.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.221 1.009 . . . . 0.0 110.376 -178.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -60.57 -40.39 91.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.126 -0.359 . . . . 0.0 111.449 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -61.55 -60.8 3.15 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.321 0.509 . . . . 0.0 111.811 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.77 -53.8 2.77 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.924 1.29 . . . . 0.0 111.613 177.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 C-N-CA 124.682 1.193 . . . . 0.0 113.673 -179.513 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 73.4 mt -115.48 108.12 16.06 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.107 1.363 . . . . 0.0 110.311 -178.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -63.63 159.5 18.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.166 -0.959 . . . . 0.0 109.749 168.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -39.18 -46.83 1.53 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.616 1.166 . . . . 0.0 113.071 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -61.09 -43.95 98.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 117.761 0.255 . . . . 0.0 111.389 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -68.69 -42.42 77.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.46 -47.34 85.86 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -56.79 -50.28 72.81 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.484 -0.76 . . . . 0.0 109.709 175.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -53.03 -57.34 10.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.656 0.382 . . . . 0.0 111.627 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.0 OUTLIER -73.44 -33.63 65.02 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 119.286 0.948 . . . . 0.0 112.472 -176.79 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.18 -38.74 92.37 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 120.691 1.587 . . . . 0.0 109.387 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.2 tm0? -61.24 -50.8 71.59 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.956 -0.465 . . . . 0.0 111.413 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -68.57 -47.68 66.19 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.788 -171.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -88.65 -39.52 13.98 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.334 1.053 . . . . 0.0 111.466 -170.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 118.742 0.701 . . . . 0.0 112.689 -171.983 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 C--O 1.222 -0.388 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -55.28 -54.39 44.09 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.279 0.945 . . . . 0.0 110.505 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mp0 -65.8 -50.81 63.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.41 0.684 . . . . 0.0 109.708 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.7 tp -51.96 -55.59 19.44 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -53.45 -49.07 68.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.119 1.368 . . . . 0.0 110.728 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -53.89 -43.3 69.54 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.735 0.243 . . . . 0.0 111.282 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -76.09 -43.42 43.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 111.277 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 tt -55.48 -56.15 23.58 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.776 1.63 . . . . 0.0 109.435 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -80.24 45.8 0.78 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.098 1.359 . . . . 0.0 113.209 -168.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 tptt . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 122.029 0.919 . . . . 0.0 111.137 -177.145 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.847 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -135.17 133.01 38.69 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.74 1.216 . . . . 0.0 108.448 173.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 29.4 t -86.88 112.33 22.88 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.8 p -78.67 162.19 26.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.547 0.739 . . . . 0.0 109.857 172.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -54.7 -31.61 58.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.311 0.577 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -51.43 -55.97 15.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.819 0.848 . . . . 0.0 110.543 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -72.98 -35.18 66.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -56.85 -42.82 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.698 -0.626 . . . . 0.0 110.663 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.07 -34.43 68.27 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.072 -1.017 . . . . 0.0 111.812 174.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.2 t -61.38 -42.83 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.432 1.014 . . . . 0.0 109.386 172.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.5 -45.99 80.75 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.673 -0.642 . . . . 0.0 109.882 171.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 CA--C 1.536 0.423 0 O-C-N 121.097 -1.002 . . . . 0.0 111.378 175.815 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 117.663 -1.161 . . . . 0.0 113.895 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.13 -52.76 8.3 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 121.914 1.743 . . . . 0.0 112.385 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -73.58 -39.39 64.69 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.591 0.356 . . . . 0.0 110.606 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.78 -54.4 44.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.2 mp -71.54 -28.04 63.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.86 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.9 -51.2 70.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.437 1.017 . . . . 0.0 108.781 168.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.47 -54.84 27.89 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 176.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.02 -61.27 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.849 0.859 . . . . 0.0 109.789 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -45.88 -54.54 8.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.24 1.416 . . . . 0.0 110.244 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.95 -43.71 98.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -64.76 -43.16 94.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.614 1.097 . . . . 0.0 111.638 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.8 -57.36 12.35 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.299 0.954 . . . . 0.0 111.098 171.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -51.26 7.28 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.322 1.049 . . . . 0.0 111.883 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.705 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 . . . . . 0 CA--C 1.535 0.379 0 CA-C-O 119.493 -0.289 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.8 mt -119.57 131.99 55.64 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.814 1.246 . . . . 0.0 110.099 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.4 p -72.92 172.6 10.62 Favored 'General case' 0 C--O 1.224 -0.277 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 167.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -57.03 -33.26 67.01 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 121.072 -1.018 . . . . 0.0 112.26 168.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -65.16 -53.33 46.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.458 0.572 . . . . 0.0 110.134 174.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -61.6 -39.85 92.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.75 -47.69 84.65 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.349 0.659 . . . . 0.0 110.263 175.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -55.57 -48.45 74.78 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.305 -0.872 . . . . 0.0 109.679 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.31 -66.62 0.37 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.578 0.751 . . . . 0.0 110.065 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.265 1.2 pt? -70.21 -29.94 66.91 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.573 -172.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -66.75 -44.5 81.3 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 120.516 1.507 . . . . 0.0 110.581 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.54 -49.39 76.89 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.311 0.505 . . . . 0.0 110.262 174.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.3 m -65.97 -50.89 62.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.171 -173.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -84.41 -40.67 17.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.843 0.857 . . . . 0.0 111.657 -173.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.594 -177.135 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 C--O 1.221 -0.428 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.55 -58.93 4.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.148 0.499 . . . . 0.0 110.41 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.94 -49.99 70.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.965 0.506 . . . . 0.0 109.737 -175.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -51.57 -55.0 21.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.763 0.825 . . . . 0.0 108.906 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.2 t80 -56.58 -47.39 79.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.645 0.778 . . . . 0.0 110.992 178.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.42 -40.31 86.29 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.543 0.61 . . . . 0.0 111.284 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 68.0 tt0 -68.91 -45.99 69.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.688 0.756 . . . . 0.0 109.269 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.54 -51.51 55.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.554 1.542 . . . . 0.0 110.591 -175.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -74.49 72.35 1.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.725 1.21 . . . . 0.0 109.548 -174.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.2 tttp . . . . . 0 CA--C 1.534 0.337 0 C-N-CA 125.156 1.382 . . . . 0.0 111.506 179.203 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.088 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -154.14 155.72 35.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.948 1.699 . . . . 0.0 107.326 -169.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.8 t -125.2 113.37 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.063 1.345 . . . . 0.0 109.016 -175.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.2 p -69.93 168.09 16.05 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 124.339 1.056 . . . . 0.0 110.857 170.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -56.49 -42.02 77.59 Favored 'General case' 0 C--N 1.342 0.246 0 O-C-N 121.865 -0.522 . . . . 0.0 109.961 169.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -58.89 -49.44 77.77 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.23 0.612 . . . . 0.0 109.585 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.36 -45.99 92.08 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.195 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -52.98 -40.55 63.83 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 122.05 -0.406 . . . . 0.0 111.094 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -55.39 -31.87 62.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.212 -0.93 . . . . 0.0 111.844 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.8 t -64.2 -35.11 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.473 -0.767 . . . . 0.0 110.168 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -66.36 -45.21 80.89 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.475 -0.765 . . . . 0.0 109.143 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 CA--C 1.533 0.307 0 CA-C-N 118.086 0.403 . . . . 0.0 110.813 178.759 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.409 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.636 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -44.64 -40.28 13.93 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.838 2.359 . . . . 0.0 114.163 171.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -71.66 -41.26 68.95 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.178 0.444 . . . . 0.0 109.823 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.57 -51.3 69.11 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.08 -39.3 85.61 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.661 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.48 -51.81 67.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 119.009 0.822 . . . . 0.0 110.443 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.12 -54.56 30.92 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.2 mt -49.78 -63.07 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -43.45 -57.24 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.149 1.38 . . . . 0.0 111.007 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.48 -36.66 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.767 -174.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -62.08 -47.54 84.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.26 0.482 . . . . 0.0 110.786 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -58.43 -55.45 34.89 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.594 0.634 . . . . 0.0 111.008 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -54.26 7.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.617 0.767 . . . . 0.0 111.515 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 178.265 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.222 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -117.24 109.03 16.37 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.41 1.484 . . . . 0.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.1 m -59.75 156.06 14.73 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.856 0.753 . . . . 0.0 109.1 167.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -45.87 -39.89 9.22 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -72.96 -34.02 66.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.02 0.827 . . . . 0.0 111.529 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.88 -49.23 73.52 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 174.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.72 -48.67 77.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.888 -0.507 . . . . 0.0 109.928 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -53.59 -57.67 9.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.133 0.424 . . . . 0.0 110.716 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.26 -33.56 69.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' C ' ' A' ' 31' ' ' LEU . 3.5 tt -56.64 -59.09 5.51 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 169.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -54.66 -42.93 71.92 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.413 -0.805 . . . . 0.0 111.538 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -62.4 -49.7 74.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.432 0.56 . . . . 0.0 110.115 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.0 m -69.51 -48.94 58.91 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.932 0.396 . . . . 0.0 110.023 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -81.85 -41.23 21.31 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 118.318 -0.849 . . . . 0.0 111.742 -169.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 . . . . . 0 CA--C 1.541 0.63 0 CA-C-N 119.273 0.942 . . . . 0.0 112.018 -170.038 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp . . . . . 0 C--O 1.222 -0.374 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -54.17 -53.44 53.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.983 0.42 . . . . 0.0 110.6 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -63.95 -53.59 47.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -51.67 -55.79 17.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.023 0.529 . . . . 0.0 109.714 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 16.9 t80 -55.66 -47.86 75.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.835 0.854 . . . . 0.0 110.754 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -56.42 -39.99 73.97 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.025 0.375 . . . . 0.0 111.932 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -49.07 17.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 109.937 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 tt -62.26 -56.81 14.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.932 1.693 . . . . 0.0 109.615 -174.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -80.87 43.61 0.7 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.965 0.906 . . . . 0.0 112.293 -169.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt . . . . . 0 CA--C 1.533 0.295 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -168.546 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -134.64 141.1 46.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.038 0.935 . . . . 0.0 109.548 173.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.407 HG23 ' CE1' ' A' ' 50' ' ' PHE . 35.5 t -88.55 120.36 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 C-N-CA 125.209 1.404 . . . . 0.0 109.529 -176.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -71.86 163.47 27.77 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 123.946 0.898 . . . . 0.0 111.107 172.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -58.52 -35.13 71.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.861 0.838 . . . . 0.0 109.876 170.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.77 -51.68 68.3 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.439 1.096 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.36 -44.5 94.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.95 0.405 . . . . 0.0 110.123 174.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -53.96 -44.3 70.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.399 0.68 . . . . 0.0 110.889 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -55.03 -31.3 60.97 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.34 -0.85 . . . . 0.0 112.396 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.57 -37.8 79.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 119.013 0.824 . . . . 0.0 110.262 172.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.37 -50.27 70.59 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.2 t . . . . . 0 CA--C 1.533 0.302 0 CA-C-N 117.86 0.3 . . . . 0.0 111.071 -177.097 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 118.225 -0.893 . . . . 0.0 112.685 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -49.67 -49.62 15.35 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.367 2.045 . . . . 0.0 112.786 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.05 -39.24 79.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.497 0.319 . . . . 0.0 110.585 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.86 -52.29 65.7 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 174.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 23.3 mt -63.75 -39.58 94.63 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.283 1.033 . . . . 0.0 110.569 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -58.15 -52.86 63.8 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.243 0.617 . . . . 0.0 110.4 172.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.3 -55.14 28.06 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.4 mt -43.62 -64.83 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.028 1.331 . . . . 0.0 109.455 171.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -45.59 -53.29 9.34 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.61 1.164 . . . . 0.0 110.7 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.51 -48.61 80.97 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.903 0.481 . . . . 0.0 110.977 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.96 -43.45 95.04 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 122.004 -0.435 . . . . 0.0 111.167 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -62.02 -58.44 7.84 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 111.081 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.17 -53.07 5.24 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.102 0.961 . . . . 0.0 111.928 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.352 0 C-N-CA 124.376 1.071 . . . . 0.0 113.646 179.658 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.4 mt -112.02 119.04 37.12 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.814 1.646 . . . . 0.0 109.622 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -61.91 169.19 2.71 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.834 1.197 . . . . 0.0 109.752 168.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -52.24 -36.96 53.87 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.004 -1.06 . . . . 0.0 111.875 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.24 -51.06 63.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.16 -41.94 97.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.48 -48.63 80.25 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.867 1.267 . . . . 0.0 109.605 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 tttp -58.38 -51.16 70.99 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -49.03 -61.99 1.77 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.339 1.055 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.277 1.0 OUTLIER -68.09 -32.73 73.25 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.322 -175.036 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -63.39 -46.77 84.9 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 119.925 1.238 . . . . 0.0 110.449 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -56.09 -52.37 64.55 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.025 173.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.0 m -66.52 -47.97 71.23 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.039 -170.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -87.56 -41.55 13.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.576 0.75 . . . . 0.0 111.981 -172.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 C--O 1.233 0.236 0 CA-C-N 118.67 0.668 . . . . 0.0 110.671 -169.198 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.7 tp . . . . . 0 C--O 1.223 -0.319 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -53.55 -55.55 24.59 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.354 0.597 . . . . 0.0 110.937 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.01 -49.07 63.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.483 0.713 . . . . 0.0 109.45 -174.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.07 -59.13 4.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.698 0.799 . . . . 0.0 108.976 177.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -56.85 -43.68 81.4 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.032 0.533 . . . . 0.0 110.804 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.51 -42.75 78.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.037 0.38 . . . . 0.0 111.19 176.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -71.12 -38.38 72.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.189 0.596 . . . . 0.0 110.174 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.87 -51.21 42.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.934 1.694 . . . . 0.0 110.406 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -78.76 66.95 4.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.016 0.927 . . . . 0.0 109.38 -169.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 CA--C 1.533 0.296 0 C-N-CA 126.719 2.007 . . . . 0.0 109.997 179.605 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.082 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -142.93 163.14 33.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.553 1.941 . . . . 0.0 107.017 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.4 t -119.59 115.71 48.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 125.988 1.715 . . . . 0.0 108.243 -173.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.8 p -81.1 163.71 22.95 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 124.238 1.015 . . . . 0.0 110.565 176.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -55.07 -32.95 62.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.119 0.485 . . . . 0.0 111.025 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.99 -34.25 77.15 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.015 0.926 . . . . 0.0 112.069 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -82.74 -42.09 18.43 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -57.6 -44.04 85.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.816 0.846 . . . . 0.0 111.262 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -60.48 -24.67 65.46 Favored 'General case' 0 CA--C 1.529 0.137 0 O-C-N 120.754 -1.216 . . . . 0.0 112.427 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.31 -48.14 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 C-N-CA 119.747 -0.781 . . . . 0.0 108.919 170.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -48.81 -42.48 36.16 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.129 -0.357 . . . . 0.0 110.447 172.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.0 111.792 179.647 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.896 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.89 -48.96 14.75 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.563 2.176 . . . . 0.0 112.38 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.86 -46.49 84.75 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.812 0.845 . . . . 0.0 110.184 -178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -57.5 -48.26 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.4 mt -63.24 -39.73 95.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.735 0.814 . . . . 0.0 110.449 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -54.86 -53.17 58.86 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.517 0.727 . . . . 0.0 109.826 170.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.06 -55.7 26.81 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.0 mt -46.8 -61.25 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 124.302 1.041 . . . . 0.0 109.114 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -46.63 -56.8 5.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.637 0.775 . . . . 0.0 110.964 -178.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -55.04 -47.12 75.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.72 0.408 . . . . 0.0 111.605 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -59.81 -47.18 86.76 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.948 -0.47 . . . . 0.0 111.023 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -61.59 -53.94 49.54 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 118.487 0.585 . . . . 0.0 110.933 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.99 -52.92 8.3 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.302 0.641 . . . . 0.0 112.02 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 176.805 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 119.612 -0.232 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -114.76 108.35 16.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.377 0.671 . . . . 0.0 110.342 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.7 t -65.77 161.55 20.61 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 168.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 67.4 mttm -38.66 -51.08 1.66 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.625 1.17 . . . . 0.0 113.042 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -66.79 -41.49 87.56 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.63 -42.94 95.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.0 tp -56.2 -61.78 2.16 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 172.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -46.59 -46.15 19.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.538 1.063 . . . . 0.0 111.732 -178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.4 -29.36 68.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.676 1.19 . . . . 0.0 109.741 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.553 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.3 tt -79.32 -58.65 3.11 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 174.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.95 -60.94 1.96 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.928 2.091 . . . . 0.0 111.914 -170.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.18 -46.63 79.29 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -177.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -65.69 -49.61 67.9 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 111.704 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -83.03 -36.09 25.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.08 -171.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 CA--C 1.538 0.516 0 C-N-CA 123.583 0.753 . . . . 0.0 110.685 -173.014 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp . . . . . 0 C--O 1.223 -0.336 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -60.29 -46.23 90.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -176.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.39 -54.85 40.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.1 tp -50.36 -55.84 13.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.968 0.507 . . . . 0.0 109.749 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 12.5 t80 -51.16 -48.48 61.85 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.101 0.961 . . . . 0.0 111.074 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.08 -44.52 94.72 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.367 0.53 . . . . 0.0 111.241 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.85 -36.77 80.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.301 0.64 . . . . 0.0 110.814 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.36 -56.81 4.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.985 1.714 . . . . 0.0 109.774 -173.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -80.17 48.75 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.933 1.693 . . . . 0.0 112.605 -168.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -170.288 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -136.36 129.25 31.02 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.633 1.173 . . . . 0.0 109.246 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.37 115.05 27.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -84.23 156.44 22.0 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.994 1.318 . . . . 0.0 109.99 178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -55.23 -31.94 61.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.477 0.656 . . . . 0.0 111.985 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -57.01 -43.97 82.36 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.868 0.867 . . . . 0.0 110.555 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -77.63 -38.71 47.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -59.78 -37.4 78.97 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 121.676 -0.64 . . . . 0.0 110.715 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -56.59 -34.1 66.86 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.303 -1.498 . . . . 0.0 112.117 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -64.09 -44.76 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.283 0.947 . . . . 0.0 109.022 170.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -51.75 -41.82 61.88 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.799 -0.563 . . . . 0.0 110.558 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 CA--C 1.537 0.466 0 CA-C-N 119.339 0.972 . . . . 0.0 111.615 178.199 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.276 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.4 -47.24 28.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.016 1.811 . . . . 0.0 112.046 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -68.04 -43.28 79.06 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.625 0.77 . . . . 0.0 110.02 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.36 -52.02 64.89 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.551 0.74 . . . . 0.0 109.239 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.5 mt -64.25 -37.35 87.18 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.236 0.614 . . . . 0.0 110.427 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -57.96 -48.28 80.42 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.597 0.635 . . . . 0.0 110.312 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.9 -55.56 27.21 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 177.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -50.21 -62.21 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.721 0.808 . . . . 0.0 109.417 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -43.25 -54.53 4.5 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 125.032 1.333 . . . . 0.0 110.443 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.2 -46.82 88.91 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.253 1.021 . . . . 0.0 110.449 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.71 -45.7 93.2 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.226 -0.296 . . . . 0.0 110.927 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -58.14 -58.79 6.89 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.075 0.398 . . . . 0.0 111.396 173.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.77 -53.04 7.82 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.318 1.447 . . . . 0.0 111.724 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 177.228 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 . . . . . 0 N--CA 1.468 0.434 0 N-CA-C 117.453 2.39 . . . . 0.0 117.453 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 59.7 mt -111.23 126.22 54.64 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.3 1.44 . . . . 0.0 110.467 176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.5 p -71.99 171.32 12.05 Favored 'General case' 0 C--O 1.224 -0.249 0 O-C-N 121.307 -0.87 . . . . 0.0 109.513 169.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -47.85 -45.3 30.01 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.104 0.866 . . . . 0.0 111.207 168.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.16 -52.04 65.41 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -61.2 -42.18 98.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.292 0.568 . . . . 0.0 110.361 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.92 -48.95 79.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.77 1.628 . . . . 0.0 109.691 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -59.56 -47.67 84.64 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.343 -0.848 . . . . 0.0 110.272 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.9 tp -52.09 -59.79 3.95 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.016 0.926 . . . . 0.0 111.208 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.3 pt? -68.77 -34.86 76.28 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.82 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.41 -43.45 94.35 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.628 1.104 . . . . 0.0 110.679 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -55.27 -53.98 49.23 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 119.639 1.109 . . . . 0.0 110.466 172.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -65.38 -54.24 31.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.014 -169.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -81.43 -37.63 27.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.475 0.71 . . . . 0.0 111.728 -174.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 112.549 -168.596 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.26 -50.16 72.12 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.539 0.336 . . . . 0.0 110.323 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.08 -53.39 50.4 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.468 0.707 . . . . 0.0 109.892 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.3 tp -50.43 -57.72 7.36 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.541 0.736 . . . . 0.0 109.254 178.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -52.73 -48.87 66.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.957 0.903 . . . . 0.0 111.322 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -55.92 -46.13 78.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.538 0.608 . . . . 0.0 111.209 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -71.14 -40.6 71.26 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 121.025 0.441 . . . . 0.0 110.593 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.64 -55.89 25.76 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.305 1.442 . . . . 0.0 109.442 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -80.81 51.72 1.58 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.184 1.794 . . . . 0.0 111.85 -169.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 mttm . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.371 1.069 . . . . 0.0 113.412 -169.425 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.748 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -134.0 127.96 33.39 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.736 1.214 . . . . 0.0 108.946 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.7 t -87.26 114.14 25.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 125.236 1.414 . . . . 0.0 108.694 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.5 m -77.75 154.31 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -48.24 -41.01 26.4 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.446 0.641 . . . . 0.0 111.571 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -64.46 -36.09 83.06 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.067 0.547 . . . . 0.0 110.601 -177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -74.75 -44.7 48.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -51.37 -40.62 59.59 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.496 0.718 . . . . 0.0 110.474 174.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -55.37 -32.93 63.0 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.647 -0.658 . . . . 0.0 111.903 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.57 -41.85 91.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.186 -0.946 . . . . 0.0 109.719 172.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.09 -44.32 97.53 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.5 t . . . . . 0 CA--C 1.534 0.341 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 176.927 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.45 -0.443 0 CA-C-O 118.057 -0.973 . . . . 0.0 113.589 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.17 -46.8 21.43 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.814 1.676 . . . . 0.0 112.061 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -72.34 -38.53 68.58 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.801 0.441 . . . . 0.0 110.646 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.72 -55.36 33.12 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.998 -0.438 . . . . 0.0 110.013 174.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.69 -33.53 76.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.3 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -56.9 -50.72 71.67 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.261 0.937 . . . . 0.0 110.517 170.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.65 -52.32 49.04 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -51.95 -62.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.775 0.83 . . . . 0.0 109.519 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -42.47 -55.47 3.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.643 1.177 . . . . 0.0 110.179 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -57.86 -52.45 65.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.904 0.881 . . . . 0.0 111.752 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -62.11 -38.66 89.75 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.769 -0.772 . . . . 0.0 111.72 -176.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -61.98 -60.56 3.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.595 0.634 . . . . 0.0 111.189 169.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.91 -48.14 16.23 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.609 1.564 . . . . 0.0 113.498 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 C-N-CA 124.859 1.264 . . . . 0.0 113.41 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 116.738 2.125 . . . . 0.0 116.738 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.8 mt -113.81 123.12 49.05 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.169 1.788 . . . . 0.0 110.234 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.9 p -66.0 167.23 10.13 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.1 -1.0 . . . . 0.0 110.147 169.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.513 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 60.2 mtpt -43.56 -47.56 7.39 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.38 -0.825 . . . . 0.0 111.709 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -67.25 -46.84 72.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -176.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -62.02 -44.99 95.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.197 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.58 -49.42 77.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.15 -53.8 38.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.934 0.788 . . . . 0.0 110.084 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.28 -51.15 71.17 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.265 1.026 . . . . 0.0 108.531 -170.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.552 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.9 tt -56.58 -55.77 29.74 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.135 -1.393 . . . . 0.0 108.378 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.79 -40.75 73.13 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.981 0.809 . . . . 0.0 111.227 -177.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.7 -49.78 73.73 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.218 0.917 . . . . 0.0 109.076 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.5 m -66.35 -51.51 56.43 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.709 -173.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -83.9 -41.64 17.2 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.259 1.024 . . . . 0.0 111.535 -172.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 . . . . . 0 CA--C 1.539 0.552 0 C-N-CA 124.145 0.978 . . . . 0.0 111.78 -170.217 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp . . . . . 0 C--O 1.22 -0.467 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -56.06 -49.51 73.58 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.037 0.446 . . . . 0.0 109.874 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.09 -54.66 34.38 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.305 0.642 . . . . 0.0 110.125 -179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.4 tp -54.77 -56.04 23.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.513 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 19.2 t80 -52.87 -47.0 68.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.699 1.199 . . . . 0.0 110.782 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -58.38 -41.21 84.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.93 0.332 . . . . 0.0 111.077 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -71.69 -39.23 70.36 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.349 0.595 . . . . 0.0 110.462 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -74.05 -55.44 6.11 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.919 1.688 . . . . 0.0 110.443 -171.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -79.19 40.3 0.41 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.697 1.199 . . . . 0.0 113.814 -167.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.17 0 O-C-N 121.165 -0.96 . . . . 0.0 111.577 -172.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.771 0 N-CA-C 111.866 -0.493 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -138.07 136.78 37.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.189 0.996 . . . . 0.0 109.813 -176.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.76 117.26 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 126.464 1.905 . . . . 0.0 109.186 -172.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -81.66 156.4 25.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.171 0.988 . . . . 0.0 110.343 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -52.9 -38.28 61.57 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 118.589 0.631 . . . . 0.0 111.005 -175.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -61.02 -39.83 91.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.4 0.68 . . . . 0.0 110.379 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.51 -44.36 62.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -54.55 -39.32 67.59 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 122.882 0.473 . . . . 0.0 111.199 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -58.98 -27.5 65.46 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.168 -0.958 . . . . 0.0 111.469 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -63.31 -44.67 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.318 -0.864 . . . . 0.0 109.203 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.9 tp -56.3 -47.1 79.34 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 171.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 49.3 t . . . . . 0 CA--C 1.538 0.486 0 CA-C-N 119.765 1.166 . . . . 0.0 111.362 178.456 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 118.358 -0.829 . . . . 0.0 112.762 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.59 -46.22 34.78 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.018 1.812 . . . . 0.0 111.915 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.4 mp0 -67.39 -43.17 81.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.575 0.75 . . . . 0.0 110.264 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.19 -52.18 65.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.87 -37.12 83.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.46 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -56.47 -51.85 66.91 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 119.112 0.869 . . . . 0.0 110.649 171.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.44 -55.02 30.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -49.18 -59.77 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.762 0.825 . . . . 0.0 109.39 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -48.2 -57.91 5.26 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.929 1.292 . . . . 0.0 110.392 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -54.6 -46.42 73.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.302 0.641 . . . . 0.0 111.399 179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -59.29 -48.94 79.72 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.927 -0.483 . . . . 0.0 110.951 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 34.3 m-85 -59.05 -56.82 17.32 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.055 0.388 . . . . 0.0 111.216 175.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.21 -53.93 3.88 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.852 1.261 . . . . 0.0 111.365 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -179.599 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' A' ' 27' ' ' GLU . 52.8 mt -107.11 108.91 20.6 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.996 0.918 . . . . 0.0 110.795 -175.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -64.94 163.57 14.26 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.051 -1.03 . . . . 0.0 109.136 167.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -38.63 -42.71 0.81 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.811 1.644 . . . . 0.0 112.073 174.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.48 -45.83 82.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.305 -0.247 . . . . 0.0 111.59 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.453 ' HB3' HD22 ' A' ' 23' ' ' LEU . 15.6 mp0 -62.72 -48.17 80.38 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.18 -47.65 80.69 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.79 0.836 . . . . 0.0 110.376 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -46.87 86.17 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.545 -0.722 . . . . 0.0 109.546 176.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.8 tp -59.37 -52.94 63.47 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.958 -0.464 . . . . 0.0 110.683 -173.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.402 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.259 1.1 pt? -71.37 -34.12 70.15 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.679 -175.184 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 mp -67.14 -42.25 84.73 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.214 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -58.99 -48.51 81.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.228 0.922 . . . . 0.0 111.265 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 m -63.72 -56.38 16.1 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.066 0.46 . . . . 0.0 110.844 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.42 -34.64 18.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.584 1.154 . . . . 0.0 112.495 -168.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 124.16 0.984 . . . . 0.0 111.374 -171.008 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.4 tp . . . . . 0 CA--C 1.517 -0.323 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -51.07 70.77 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.22 -54.46 29.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.7 tp -50.3 -55.61 14.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.486 0.715 . . . . 0.0 109.79 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -53.03 -51.46 61.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.109 0.564 . . . . 0.0 110.331 177.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -57.51 -38.57 74.86 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.434 0.561 . . . . 0.0 112.162 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.19 -33.78 72.15 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.237 0.615 . . . . 0.0 110.195 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -80.39 -56.13 4.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.628 1.171 . . . . 0.0 110.824 -173.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.02 40.87 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.462 1.505 . . . . 0.0 114.816 -166.591 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -170.625 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.679 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -138.62 134.08 33.28 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.115 0.957 . . . . 0.0 110.579 -175.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.6 t -87.96 119.49 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 124.097 0.959 . . . . 0.0 109.651 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 84.3 p -82.56 158.03 23.27 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.914 0.886 . . . . 0.0 111.132 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -55.61 -37.61 68.37 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.127 0.489 . . . . 0.0 110.801 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -56.59 -47.47 79.5 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.833 1.253 . . . . 0.0 109.973 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.8 -36.98 76.13 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.385 0.612 . . . . 0.0 109.61 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -56.27 -37.52 69.93 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.797 -0.564 . . . . 0.0 110.74 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -55.77 -35.96 66.81 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.645 -1.284 . . . . 0.0 111.896 171.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.56 -48.76 83.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.77 -40.76 30.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.417 0.687 . . . . 0.0 111.583 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.3 t . . . . . 0 N--CA 1.468 0.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.93 175.893 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 117.877 -1.059 . . . . 0.0 113.187 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.45 -47.11 25.95 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.043 1.829 . . . . 0.0 112.552 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.7 -46.14 73.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.365 0.666 . . . . 0.0 109.844 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -55.24 -50.98 68.07 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 109.544 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.92 -37.49 86.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.94 0.896 . . . . 0.0 110.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -57.03 -50.31 73.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.863 0.756 . . . . 0.0 110.353 170.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.17 -55.39 28.5 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 178.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.1 mt -50.93 -58.87 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -46.39 -57.68 4.43 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.988 1.315 . . . . 0.0 111.026 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.39 -37.88 88.3 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.267 0.485 . . . . 0.0 111.071 -175.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -61.79 -43.79 98.15 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.74 -0.6 . . . . 0.0 111.022 177.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -60.02 -58.25 9.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.018 -0.426 . . . . 0.0 111.199 171.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.07 -53.53 4.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.214 1.006 . . . . 0.0 111.492 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 178.525 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.1 mt -114.62 112.54 23.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.527 1.131 . . . . 0.0 111.58 -175.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.1 p -62.05 165.08 5.93 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.989 -1.069 . . . . 0.0 110.112 168.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -40.67 -46.74 2.66 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 123.915 0.886 . . . . 0.0 111.705 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.61 -52.44 65.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.496 0.318 . . . . 0.0 110.242 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -65.87 -39.75 90.99 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.035 0.445 . . . . 0.0 110.082 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.26 -49.14 78.29 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.81 1.644 . . . . 0.0 109.261 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -58.82 -46.85 86.69 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.386 -0.821 . . . . 0.0 110.315 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.8 tp -52.54 -58.64 6.12 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.41 -0.806 . . . . 0.0 111.824 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.279 1.2 pt? -69.97 -34.74 73.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 119.246 -0.982 . . . . 0.0 112.099 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.3 -42.06 99.0 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 119.535 1.062 . . . . 0.0 110.542 175.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -57.21 -52.91 63.43 Favored 'General case' 0 CA--C 1.527 0.064 0 CA-C-N 119.232 0.924 . . . . 0.0 110.924 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.9 m -62.32 -52.22 64.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.722 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -89.11 -34.96 16.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.07 0.948 . . . . 0.0 112.89 -168.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -168.807 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 tp . . . . . 0 C--O 1.222 -0.345 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -54.16 -51.94 62.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 122.17 0.188 . . . . 0.0 110.955 177.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -64.05 -53.56 47.93 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.328 0.651 . . . . 0.0 110.097 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.9 tp -50.05 -57.44 7.6 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.602 0.761 . . . . 0.0 109.119 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -54.1 -46.26 72.06 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.856 0.863 . . . . 0.0 111.403 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.92 -44.48 86.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.808 0.731 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -72.45 -46.01 56.92 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.868 0.366 . . . . 0.0 110.179 -176.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.06 -59.56 4.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.379 1.472 . . . . 0.0 109.048 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -80.37 47.53 0.93 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.93 1.692 . . . . 0.0 110.556 -173.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ttmm . . . . . 0 CA--C 1.533 0.314 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -167.735 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.683 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -132.39 137.94 47.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.455 1.102 . . . . 0.0 108.582 172.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.1 t -88.22 114.7 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 126.02 1.728 . . . . 0.0 108.569 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.7 p -76.47 159.57 30.29 Favored 'General case' 0 C--N 1.335 -0.047 0 C-N-CA 123.741 0.816 . . . . 0.0 110.53 172.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -55.33 -34.79 64.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.499 0.666 . . . . 0.0 111.174 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.88 -49.44 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.093 0.957 . . . . 0.0 110.393 174.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.65 -40.27 69.8 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -55.22 -41.85 72.58 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 121.796 -0.565 . . . . 0.0 110.601 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -57.59 -31.72 66.47 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.482 -0.761 . . . . 0.0 112.365 176.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.58 -28.84 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.558 -0.714 . . . . 0.0 110.932 171.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -74.08 -45.46 49.1 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.202 -0.936 . . . . 0.0 108.608 169.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 N--CA 1.465 0.287 0 O-C-N 121.267 -0.896 . . . . 0.0 111.76 -178.927 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.387 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.85 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.82 -44.37 31.95 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.266 1.977 . . . . 0.0 112.711 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -71.67 -42.25 67.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.896 0.478 . . . . 0.0 110.312 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.29 -52.08 65.84 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.142 0.496 . . . . 0.0 109.86 174.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.4 mt -64.14 -37.9 89.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.522 0.729 . . . . 0.0 109.826 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -55.88 -52.59 63.56 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 118.292 0.497 . . . . 0.0 110.047 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.01 -55.68 20.12 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.25 -54.75 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -46.25 -54.81 8.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.793 1.237 . . . . 0.0 109.626 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.59 -44.93 93.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.467 0.707 . . . . 0.0 110.824 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -61.25 -45.22 95.42 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 117.957 0.344 . . . . 0.0 111.375 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 30.5 m-85 -60.79 -60.51 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.013 -0.429 . . . . 0.0 111.084 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.35 -49.78 6.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.037 1.735 . . . . 0.0 112.758 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 123.956 0.903 . . . . 0.0 113.396 176.753 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.86 152.76 23.47 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 125.889 1.676 . . . . 0.0 107.047 172.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.8 p -94.45 174.07 7.31 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.503 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -53.21 -38.93 63.32 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 119.649 1.113 . . . . 0.0 112.337 167.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.7 -51.88 63.07 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -62.64 -40.42 96.95 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.267 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.84 -49.86 75.79 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.132 0.573 . . . . 0.0 109.476 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -53.89 -51.04 64.98 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.621 -0.674 . . . . 0.0 109.978 175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -51.16 -62.23 1.74 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.416 0.686 . . . . 0.0 111.676 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.408 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.269 1.0 OUTLIER -70.79 -30.64 67.16 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.876 -176.156 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.28 -42.99 96.15 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 120.398 1.453 . . . . 0.0 109.63 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -58.32 -50.54 73.25 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.856 0.753 . . . . 0.0 110.838 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 m -61.15 -56.03 25.48 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.044 0.449 . . . . 0.0 110.719 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -87.13 -40.7 14.39 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.089 1.356 . . . . 0.0 112.078 -169.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 123.872 0.869 . . . . 0.0 111.033 -170.005 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.2 tp . . . . . 0 C--O 1.22 -0.458 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.75 -53.01 60.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.672 0.669 . . . . 0.0 110.495 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -62.5 -58.25 8.28 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.8 mp -53.36 -52.7 58.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 7.6 t80 -57.43 -45.85 84.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.703 0.401 . . . . 0.0 110.641 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -58.28 -41.68 84.9 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.062 0.392 . . . . 0.0 111.336 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -69.89 -44.12 70.4 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.526 0.679 . . . . 0.0 109.768 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.55 -52.22 23.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.272 1.429 . . . . 0.0 110.851 -172.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -75.87 74.4 2.8 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.063 0.945 . . . . 0.0 109.691 -172.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 124.34 1.056 . . . . 0.0 111.788 174.584 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.166 0 N-CA-C 111.918 -0.473 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -134.3 168.89 18.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.026 1.33 . . . . 0.0 109.285 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 67.5 t -139.55 109.39 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.05 1.34 . . . . 0.0 107.52 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.7 m -80.71 161.02 24.78 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 122.825 0.45 . . . . 0.0 111.098 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -51.55 -38.97 56.84 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-O 121.423 0.63 . . . . 0.0 110.753 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.09 -38.3 90.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.057 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.27 -45.35 63.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.4 -40.51 62.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.894 0.478 . . . . 0.0 110.966 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -55.52 -30.78 61.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.983 0.513 . . . . 0.0 111.882 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.4 t -61.7 -41.01 88.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 121.371 -0.831 . . . . 0.0 109.645 172.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -48.46 81.61 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 172.083 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 68.0 t . . . . . 0 CA--C 1.535 0.379 0 O-C-N 121.724 -0.61 . . . . 0.0 111.485 179.465 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.47 -54.3 5.29 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.03 1.82 . . . . 0.0 112.604 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -74.26 -35.96 63.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.387 0.275 . . . . 0.0 111.71 -177.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.97 -56.56 20.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.558 0.694 . . . . 0.0 109.303 176.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.64 -31.31 70.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.298 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.79 -50.24 71.01 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.706 1.139 . . . . 0.0 110.381 169.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.39 -55.41 22.35 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.599 -1.0 . . . . 0.0 110.599 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.403 HD13 HG21 ' A' ' 9' ' ' ILE . 48.5 mt -54.43 -59.12 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -42.32 -54.71 3.65 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.784 1.234 . . . . 0.0 110.539 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.53 -45.04 92.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.707 0.803 . . . . 0.0 110.062 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -59.9 -45.47 92.45 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 122.32 -0.238 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.1 m-85 -61.02 -58.85 6.7 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.15 0.432 . . . . 0.0 111.329 173.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -46.84 7.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.398 1.479 . . . . 0.0 112.748 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.418 0 C-N-CA 124.668 1.187 . . . . 0.0 113.681 176.963 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.2 mt -110.24 110.32 21.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.917 0.887 . . . . 0.0 109.202 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.6 p -69.33 163.54 24.89 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 169.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 99.3 mttt -39.16 -46.09 1.41 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.202 1.001 . . . . 0.0 113.343 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -74.38 -32.63 62.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.191 0.451 . . . . 0.0 112.077 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -69.23 -45.58 69.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.93 -46.22 82.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.264 1.425 . . . . 0.0 109.434 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -57.38 -53.3 59.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 121.585 -0.697 . . . . 0.0 109.75 173.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -54.28 -53.37 54.61 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.878 0.471 . . . . 0.0 111.171 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.285 1.2 pt? -70.89 -35.17 72.21 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 118.903 -1.119 . . . . 0.0 112.081 -176.556 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.63 -36.59 84.13 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 119.591 1.087 . . . . 0.0 110.185 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -51.85 67.28 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.765 0.711 . . . . 0.0 109.808 173.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -63.75 -56.23 17.15 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 110.032 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -83.56 -36.99 23.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.239 1.016 . . . . 0.0 111.842 -169.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -169.764 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.9 tp . . . . . 0 C--O 1.224 -0.24 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -54.01 -55.75 24.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.205 0.202 . . . . 0.0 110.861 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.63 -47.99 68.03 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -173.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 77.3 mt -50.91 -61.95 1.9 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 12.7 t80 -55.22 -44.37 75.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.323 0.51 . . . . 0.0 111.267 -178.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -56.64 -43.8 80.67 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.348 0.259 . . . . 0.0 111.085 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -72.21 -43.37 64.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.465 0.65 . . . . 0.0 109.863 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.73 -51.53 54.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.985 1.714 . . . . 0.0 110.562 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -77.3 71.87 3.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 109.673 -172.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 125.573 1.549 . . . . 0.0 111.956 178.515 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -147.95 160.67 42.57 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.47 1.908 . . . . 0.0 107.315 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 42.4 t -116.43 115.39 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 125.54 1.536 . . . . 0.0 108.098 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.8 p -73.6 166.61 22.95 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.392 1.077 . . . . 0.0 110.622 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -53.2 -43.65 67.35 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.115 0.483 . . . . 0.0 110.156 171.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -64.16 -46.82 82.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 122.932 0.493 . . . . 0.0 109.724 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.94 -47.01 88.39 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.25 0.548 . . . . 0.0 109.652 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -54.1 -39.89 66.8 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.857 0.863 . . . . 0.0 111.181 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -56.2 -27.34 54.28 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.422 -0.799 . . . . 0.0 111.902 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.85 -46.86 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 119.102 0.865 . . . . 0.0 109.189 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -40.53 69.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.417 0.687 . . . . 0.0 109.856 174.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.4 t . . . . . 0 CA--C 1.543 0.691 0 O-C-N 121.378 -0.826 . . . . 0.0 112.173 174.747 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 117.665 -1.159 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -40.58 -45.57 4.57 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.032 2.488 . . . . 0.0 114.622 170.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -72.4 -42.5 65.08 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.886 0.766 . . . . 0.0 110.297 -176.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -57.08 -51.73 68.11 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.71 -41.28 90.46 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.088 0.955 . . . . 0.0 110.268 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.72 -51.36 69.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.334 0.516 . . . . 0.0 110.046 173.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.54 -56.75 18.45 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 177.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.89 -58.63 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 123.952 0.901 . . . . 0.0 109.289 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -47.57 -55.55 9.0 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.479 1.512 . . . . 0.0 110.402 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.65 -45.71 88.73 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.132 0.573 . . . . 0.0 111.618 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -58.92 -49.17 78.83 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.131 -0.355 . . . . 0.0 110.827 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 24.7 m-85 -58.29 -56.45 21.97 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.013 -0.43 . . . . 0.0 111.197 174.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.02 -51.68 7.63 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.704 1.202 . . . . 0.0 112.48 177.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.455 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 177.486 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 119.643 -0.218 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.6 mt -120.39 129.9 54.13 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.83 1.252 . . . . 0.0 107.911 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 t -93.55 168.07 11.27 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 167.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -48.14 -34.62 10.18 Favored 'General case' 0 N--CA 1.461 0.125 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -170.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -70.5 -40.63 73.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.959 -0.463 . . . . 0.0 110.742 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.4 -42.42 75.12 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.51 -48.56 80.44 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 122.435 0.294 . . . . 0.0 110.987 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -62.69 -42.43 99.63 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 118.031 -1.468 . . . . 0.0 109.207 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.1 tp -54.49 -59.17 5.05 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.99 -0.444 . . . . 0.0 111.192 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.254 1.3 pt? -70.28 -35.33 73.65 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 119.032 -1.067 . . . . 0.0 112.245 -174.9 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -42.51 98.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 119.414 1.006 . . . . 0.0 110.119 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.22 -48.48 81.55 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.275 0.943 . . . . 0.0 111.11 173.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -61.19 -55.95 26.28 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.043 0.449 . . . . 0.0 110.562 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -87.1 -38.68 16.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.451 1.1 . . . . 0.0 112.069 -169.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 CA--C 1.535 0.37 0 C-N-CA 124.118 0.967 . . . . 0.0 111.758 -170.878 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.0 tp . . . . . 0 C--O 1.222 -0.382 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.74 -51.91 67.05 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.28 0.491 . . . . 0.0 110.014 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -66.9 -49.48 65.45 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.777 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.1 tp -54.51 -53.28 56.46 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -54.92 -47.89 73.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.486 0.714 . . . . 0.0 110.624 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -58.4 -40.44 82.42 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.168 0.44 . . . . 0.0 111.305 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.23 -47.8 63.73 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 121.668 0.747 . . . . 0.0 109.33 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -64.57 -57.45 9.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.609 1.563 . . . . 0.0 110.537 -174.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -74.34 75.18 1.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 tttp . . . . . 0 CA--C 1.537 0.447 0 C-N-CA 124.651 1.18 . . . . 0.0 111.504 178.489 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.145 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -142.22 160.76 39.6 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.182 0.993 . . . . 0.0 110.102 -176.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.46 103.95 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 76.5 p -68.15 173.6 4.56 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.355 0.662 . . . . 0.0 109.454 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -58.36 -35.87 72.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.737 0.78 . . . . 0.0 110.343 171.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -62.54 -51.69 66.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.857 0.863 . . . . 0.0 109.727 178.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.95 -46.29 88.38 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.02 -41.5 71.4 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.51 -0.744 . . . . 0.0 111.559 -177.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -56.54 -27.81 58.53 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.455 -0.778 . . . . 0.0 112.584 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.53 -35.98 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 119.432 1.015 . . . . 0.0 110.484 170.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.88 -48.76 73.1 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 171.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 63.8 t . . . . . 0 CA--C 1.532 0.277 0 O-C-N 122.112 -0.368 . . . . 0.0 111.03 178.461 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.72 -46.68 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.098 1.866 . . . . 0.0 112.109 175.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -68.85 -41.96 77.77 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.307 0.643 . . . . 0.0 110.064 -177.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.22 -52.11 65.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.03 -34.08 76.93 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 119.405 -0.331 . . . . 0.0 110.405 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -59.14 -51.06 71.66 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.708 0.685 . . . . 0.0 110.57 169.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.75 -54.19 34.72 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.4 mt -44.61 -64.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 125.084 1.354 . . . . 0.0 109.651 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -45.25 -53.96 7.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.74 0.816 . . . . 0.0 110.443 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.16 -49.95 74.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.934 0.894 . . . . 0.0 111.863 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.16 -45.57 92.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.529 1.058 . . . . 0.0 110.944 -179.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -58.74 -53.55 57.11 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.88 -0.513 . . . . 0.0 110.759 177.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -53.93 19.32 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.889 1.276 . . . . 0.0 111.463 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.313 0 O-C-N 121.406 -0.808 . . . . 0.0 112.105 172.654 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.1 mt -106.65 127.76 53.62 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 125.62 1.568 . . . . 0.0 109.535 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.2 p -71.92 171.4 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.287 -0.883 . . . . 0.0 109.044 168.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 8.4 mtmp? -45.86 -44.61 14.49 Favored 'General case' 0 C--O 1.226 -0.173 0 O-C-N 121.637 -0.664 . . . . 0.0 110.969 167.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mp0 -68.39 -47.69 66.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.746 0.418 . . . . 0.0 109.936 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -61.62 -41.74 97.9 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.48 -48.77 80.38 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.702 1.201 . . . . 0.0 109.851 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -59.87 -48.9 79.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.228 -0.92 . . . . 0.0 110.093 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.4 tp -50.98 -60.86 2.64 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.88 0.872 . . . . 0.0 111.244 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 1.1 pt? -69.18 -31.67 70.45 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 119.063 -1.055 . . . . 0.0 112.199 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -65.92 -43.55 87.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 119.994 1.27 . . . . 0.0 110.55 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -55.84 -54.02 49.59 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.013 0.824 . . . . 0.0 110.677 171.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.0 m -65.67 -52.71 49.52 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.564 0.221 . . . . 0.0 111.289 -169.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -80.56 -39.05 28.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.634 0.773 . . . . 0.0 111.346 -175.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.364 -169.803 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp . . . . . 0 C--O 1.223 -0.321 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -52.84 -57.2 11.0 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.087 0.47 . . . . 0.0 109.92 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.49 -52.26 64.19 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.336 0.655 . . . . 0.0 110.114 -175.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.18 -54.5 35.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.755 0.822 . . . . 0.0 109.141 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.468 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 38.5 t80 -57.79 -45.3 86.23 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.038 0.535 . . . . 0.0 111.337 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.91 -42.94 95.01 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.144 0.884 . . . . 0.0 111.105 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.19 -50.52 67.77 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.807 0.813 . . . . 0.0 109.266 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -60.08 4.4 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 126.328 1.851 . . . . 0.0 109.715 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -80.35 49.82 1.19 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.908 1.683 . . . . 0.0 112.407 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? . . . . . 0 CA--C 1.534 0.355 0 CA-C-O 121.315 0.579 . . . . 0.0 109.797 -177.798 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.951 0 CA-C-O 119.695 -0.503 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -143.64 131.68 21.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.985 0.914 . . . . 0.0 110.411 -177.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 37.9 t -87.43 113.77 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 C-N-CA 127.303 2.241 . . . . 0.0 108.349 -171.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 96.7 p -79.72 165.68 22.57 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.095 0.558 . . . . 0.0 110.359 173.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -55.42 -33.94 63.98 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.917 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.96 -54.82 29.36 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.413 0.685 . . . . 0.0 110.226 173.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -69.11 -38.63 79.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -58.44 -39.51 80.03 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 121.763 -0.586 . . . . 0.0 110.778 179.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -57.62 -35.17 70.12 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.464 1.484 . . . . 0.0 111.967 174.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.98 -39.57 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 121.205 -0.935 . . . . 0.0 109.3 171.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.39 -43.85 88.69 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 169.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.7 t . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 119.587 1.085 . . . . 0.0 110.731 178.556 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.456 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.62 -40.79 30.68 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.54 2.16 . . . . 0.0 113.294 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -71.1 -46.19 62.22 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.115 0.566 . . . . 0.0 109.994 -176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -58.37 -50.78 72.42 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.38 -40.81 95.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.997 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -56.96 -50.88 71.29 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 118.556 0.616 . . . . 0.0 110.527 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.67 -54.47 32.78 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 9' ' ' ILE . 57.1 mt -50.01 -64.36 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 123.93 0.892 . . . . 0.0 109.352 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -45.73 -52.19 11.39 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.18 1.392 . . . . 0.0 110.239 -178.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.82 -45.96 91.56 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.626 1.171 . . . . 0.0 110.457 -175.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.29 -49.04 79.19 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.252 -0.28 . . . . 0.0 110.557 178.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -56.28 -60.54 3.36 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 117.972 0.351 . . . . 0.0 111.388 175.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.28 -55.12 3.46 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.923 1.689 . . . . 0.0 111.914 177.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 CA--C 1.539 0.542 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.4 mt -119.99 135.19 55.01 Favored 'General case' 0 C--N 1.345 0.402 0 C-N-CA 125.658 1.583 . . . . 0.0 109.575 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.9 p -74.13 172.67 11.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.105 0.866 . . . . 0.0 109.181 168.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -55.33 -38.42 68.71 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.041 -1.037 . . . . 0.0 112.152 168.306 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.31 -52.41 64.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.84 -40.78 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.55 -47.31 86.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.368 1.067 . . . . 0.0 110.027 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -57.24 -51.44 69.36 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.664 -0.815 . . . . 0.0 109.536 172.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.1 tp -52.6 -55.86 19.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.629 0.372 . . . . 0.0 111.773 -173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.26 1.3 pt? -69.85 -35.55 74.82 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 119.143 -1.023 . . . . 0.0 112.249 -177.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -64.77 -40.4 95.2 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 120.562 1.528 . . . . 0.0 109.936 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -56.34 -52.18 65.53 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.007 0.523 . . . . 0.0 111.003 171.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.55 -49.6 58.24 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 -172.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -86.47 -37.5 18.21 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.173 0.989 . . . . 0.0 111.589 -169.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 . . . . . 0 CA--C 1.539 0.55 0 C-N-CA 124.22 1.008 . . . . 0.0 111.649 -175.145 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.223 -0.305 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.48 -55.39 32.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -60.82 -53.74 53.71 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.069 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.48 -54.57 39.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.793 0.837 . . . . 0.0 109.183 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' A' ' 61' ' ' VAL . 41.2 t80 -57.51 -45.42 84.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.515 0.726 . . . . 0.0 111.196 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -61.18 -45.03 96.29 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 118.799 0.727 . . . . 0.0 110.89 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.13 -47.07 84.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.559 0.695 . . . . 0.0 109.346 -176.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -61.2 2.52 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.887 1.675 . . . . 0.0 109.77 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -80.58 54.99 2.2 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.476 1.51 . . . . 0.0 111.75 -168.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 mttp . . . . . 0 C--N 1.33 -0.239 0 C-N-CA 123.214 0.605 . . . . 0.0 111.396 -174.86 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.759 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -138.76 128.93 25.52 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.561 1.144 . . . . 0.0 109.691 179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.52 HG23 ' CE1' ' A' ' 50' ' ' PHE . 66.3 t -87.37 99.8 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 -178.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.3 m -68.53 155.52 39.79 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -46.5 -36.99 7.25 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.542 0.686 . . . . 0.0 112.178 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -60.62 -41.19 94.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.718 0.807 . . . . 0.0 110.927 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -72.34 -40.84 67.09 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 174.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.4 -42.63 64.19 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.708 -0.62 . . . . 0.0 110.961 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -39.74 20.09 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.667 -0.645 . . . . 0.0 112.494 172.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.1 t -61.42 -39.84 84.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 O-C-N 121.746 -0.596 . . . . 0.0 110.149 175.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.44 -51.63 69.07 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t . . . . . 0 CA--C 1.533 0.292 0 CA-C-N 117.929 0.331 . . . . 0.0 111.057 -176.461 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 117.695 -1.145 . . . . 0.0 112.403 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -50.75 11.14 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.367 2.045 . . . . 0.0 112.315 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.64 -48.04 82.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.192 0.597 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.04 -50.17 71.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.764 0.426 . . . . 0.0 109.852 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.65 -38.7 92.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.108 0.963 . . . . 0.0 109.593 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -59.56 -52.37 65.83 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.271 0.487 . . . . 0.0 110.387 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.51 -54.22 36.06 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.8 mt -45.19 -64.32 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.558 1.143 . . . . 0.0 109.497 172.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -48.21 -56.13 8.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.463 1.505 . . . . 0.0 110.534 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -56.91 -47.02 81.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.56 0.344 . . . . 0.0 110.889 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -60.51 -44.17 96.29 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.984 -0.448 . . . . 0.0 111.113 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -59.66 -57.28 13.62 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 118.161 0.437 . . . . 0.0 111.132 174.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -50.52 13.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.776 0.83 . . . . 0.0 111.633 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.707 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 119.712 -0.185 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.7 mt -100.67 118.98 37.9 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.026 0.93 . . . . 0.0 110.459 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.6 m -68.68 157.33 36.48 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 166.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -40.71 2.38 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 173.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.6 -53.48 54.07 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.646 0.378 . . . . 0.0 111.294 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.77 -44.9 94.97 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.76 -47.72 81.69 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.294 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.14 -58.45 7.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.069 173.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.7 tp -49.52 -55.4 13.5 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 123.337 0.398 . . . . 0.0 111.661 -173.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.271 0.7 OUTLIER -72.21 -32.36 66.7 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.719 -174.886 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.06 -42.85 93.83 Favored 'General case' 0 CA--C 1.523 -0.079 0 CA-C-N 120.065 1.302 . . . . 0.0 109.943 174.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.28 -47.57 81.76 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.954 -0.699 . . . . 0.0 109.928 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.3 m -69.15 -50.5 47.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.606 -173.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -87.59 -38.2 16.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.562 -169.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 . . . . . 0 CA--C 1.541 0.632 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -167.482 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 tp . . . . . 0 C--O 1.224 -0.254 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.79 -52.03 65.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.98 -57.0 14.45 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.45 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.22 -53.49 49.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.955 0.502 . . . . 0.0 110.047 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.52 -48.06 75.27 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.303 178.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.49 -42.25 95.94 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.106 0.412 . . . . 0.0 111.321 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.0 -48.19 59.14 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.553 0.692 . . . . 0.0 109.624 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.45 -57.27 10.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.379 1.472 . . . . 0.0 109.557 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -80.33 44.88 0.72 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.73 1.212 . . . . 0.0 112.475 -168.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? . . . . . 0 CA--C 1.531 0.224 0 C-N-CA 124.071 0.949 . . . . 0.0 111.211 -172.132 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.854 0 CA-C-O 119.496 -0.613 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -136.99 127.71 27.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.236 1.014 . . . . 0.0 109.173 -172.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.2 t -88.69 110.88 21.83 Favored 'Isoleucine or valine' 0 C--N 1.339 0.14 0 C-N-CA 123.903 0.881 . . . . 0.0 108.653 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.7 p -74.32 166.21 23.86 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.941 0.897 . . . . 0.0 110.242 171.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -56.81 -35.86 69.24 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.453 0.644 . . . . 0.0 110.173 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -61.18 -49.48 77.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.083 0.953 . . . . 0.0 110.179 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.33 -44.22 92.2 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.69 176.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -52.69 -40.9 63.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.665 0.786 . . . . 0.0 110.547 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -35.91 46.8 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.102 0.561 . . . . 0.0 112.173 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.16 -38.31 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 118.698 0.681 . . . . 0.0 110.227 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.63 -45.68 74.67 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.215 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 CA--C 1.534 0.354 0 O-C-N 121.646 -0.659 . . . . 0.0 111.393 177.892 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 117.858 -1.067 . . . . 0.0 112.298 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -47.5 -50.4 11.46 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.319 2.013 . . . . 0.0 112.449 177.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.98 -47.65 83.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.251 0.62 . . . . 0.0 110.826 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -56.41 -50.22 72.24 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.686 0.395 . . . . 0.0 110.094 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.14 -37.2 83.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.058 0.943 . . . . 0.0 109.853 -176.097 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -58.53 -54.12 50.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.831 0.452 . . . . 0.0 109.805 171.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.17 25.61 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -45.81 -62.81 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.401 1.48 . . . . 0.0 109.818 173.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -45.25 -57.51 3.93 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.49 1.116 . . . . 0.0 110.151 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.09 -48.15 79.3 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.238 -0.411 . . . . 0.0 112.086 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -62.81 -45.93 90.33 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.751 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -56.98 -53.31 59.45 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.732 0.696 . . . . 0.0 111.285 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -46.46 -59.47 2.95 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.319 1.048 . . . . 0.0 110.429 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.233 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.873 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.531 0.245 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 27' ' ' GLU . 80.5 mt -96.7 109.34 22.0 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.753 0.821 . . . . 0.0 110.321 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -59.07 164.26 3.12 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.179 0.9 . . . . 0.0 109.316 168.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -48.21 -33.83 9.2 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 169.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -63.23 -51.91 64.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.333 0.515 . . . . 0.0 109.616 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HB3' HD22 ' A' ' 23' ' ' LEU . 1.3 mp0 -57.9 -50.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.2 -45.67 87.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.065 -172.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -58.3 -56.07 26.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.775 -0.578 . . . . 0.0 109.854 171.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -52.4 -53.22 47.92 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.891 0.476 . . . . 0.0 111.523 -172.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.252 0.9 OUTLIER -73.14 -31.73 64.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.523 -176.916 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp -66.39 -42.05 88.48 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 120.886 1.675 . . . . 0.0 109.157 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.8 tm0? -56.59 -51.03 70.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 122.512 0.325 . . . . 0.0 111.643 172.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -70.66 -50.97 31.09 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 118.453 0.569 . . . . 0.0 110.144 -173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -83.77 -37.61 22.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.841 0.856 . . . . 0.0 111.024 -169.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 . . . . . 0 C--O 1.235 0.293 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.861 -172.818 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 23.6 tp . . . . . 0 C--O 1.224 -0.27 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.15 -53.08 60.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.323 0.51 . . . . 0.0 110.02 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -66.1 -49.43 67.57 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.959 0.504 . . . . 0.0 109.732 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -54.27 -56.0 22.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -56.43 -46.29 80.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.724 0.809 . . . . 0.0 111.072 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -58.91 -41.45 87.29 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.149 0.431 . . . . 0.0 111.18 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -65.46 -43.36 90.58 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -73.48 -53.73 9.91 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.455 1.502 . . . . 0.0 111.555 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -81.02 51.95 1.67 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.899 1.28 . . . . 0.0 113.784 -167.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? . . . . . 0 N--CA 1.466 0.363 0 C-N-CA 126.195 1.798 . . . . 0.0 113.301 -172.305 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.633 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -145.62 137.93 25.63 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.093 0.557 . . . . 0.0 111.113 169.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 41.6 t -89.09 119.12 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 C-N-CA 126.635 1.974 . . . . 0.0 109.796 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.2 m -73.49 153.56 40.28 Favored 'General case' 0 C--O 1.228 -0.077 0 C-N-CA 124.967 1.307 . . . . 0.0 109.92 172.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -50.26 -39.96 46.59 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.158 0.504 . . . . 0.0 111.408 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -63.28 -36.41 83.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.399 0.68 . . . . 0.0 110.934 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.32 -44.34 52.92 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -52.42 -40.75 62.54 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 123.256 0.622 . . . . 0.0 110.313 175.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -54.82 -33.59 61.79 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.579 -0.701 . . . . 0.0 111.851 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.71 -42.8 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.375 -0.828 . . . . 0.0 109.322 173.833 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.46 -47.17 84.92 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 170.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.3 t . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 119.362 0.983 . . . . 0.0 111.68 179.889 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 117.411 -1.28 . . . . 0.0 113.701 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.56 -49.88 12.51 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.079 1.853 . . . . 0.0 112.944 176.109 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -75.54 -38.82 59.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.783 0.433 . . . . 0.0 110.559 -175.642 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -57.03 -53.21 60.67 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.62 0.724 . . . . 0.0 109.222 175.49 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.1 mt -61.49 -38.49 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.01 0.924 . . . . 0.0 109.739 178.531 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -57.98 -45.97 85.9 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 119.188 0.903 . . . . 0.0 111.229 172.768 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.01 -54.43 36.98 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 176.49 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.5 mt -51.91 -61.14 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 123.49 0.716 . . . . 0.0 109.452 178.026 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -43.42 -58.58 2.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.231 1.812 . . . . 0.0 109.981 177.077 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -55.94 -46.97 78.37 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.78 0.832 . . . . 0.0 111.292 -178.504 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -59.97 -47.48 85.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 119.32 -0.371 . . . . 0.0 111.203 179.302 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -61.76 -55.34 31.22 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.471 173.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.56 -51.55 2.93 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.354 1.862 . . . . 0.0 112.226 177.566 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 175.65 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 111.263 0.098 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -94.86 112.12 23.86 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.318 1.047 . . . . 0.0 110.039 -175.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.9 t -73.14 168.32 19.33 Favored 'General case' 0 C--O 1.23 0.051 0 C-N-CA 117.791 -1.563 . . . . 0.0 108.965 167.679 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -38.82 -45.39 1.15 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.716 1.606 . . . . 0.0 111.992 178.595 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.15 -46.32 84.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -62.2 -50.08 73.23 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.325 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.01 -50.52 73.76 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -175.787 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -51.64 -57.15 9.99 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 176.218 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -44.75 95.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -168.479 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.451 HD23 ' C ' ' A' ' 31' ' ' LEU . 4.8 tt -56.26 -57.31 12.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 175.064 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.04 -41.3 78.42 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 121.079 -1.013 . . . . 0.0 112.043 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.19 -49.92 72.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.557 1.071 . . . . 0.0 109.121 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 26.3 m -69.96 -51.12 35.22 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.417 -171.749 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -81.63 -39.08 24.99 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.774 0.83 . . . . 0.0 110.994 -172.578 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 . . . . . 0 C--O 1.235 0.327 0 CA-C-N 118.593 0.633 . . . . 0.0 110.66 -170.262 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.5 tp . . . . . 0 C--O 1.222 -0.371 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -52.22 -54.84 26.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.01 0.368 . . . . 0.0 110.697 177.303 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -63.42 -50.01 71.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.497 0.719 . . . . 0.0 109.759 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 tp -55.63 -53.82 51.76 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.344 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -55.02 -46.25 75.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.914 0.485 . . . . 0.0 109.994 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.42 -45.71 80.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.202 0.455 . . . . 0.0 111.811 -179.183 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -77.01 -36.97 55.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 -176.531 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.08 -47.02 69.43 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.072 1.349 . . . . 0.0 110.182 -178.24 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.5 64.44 2.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.756 1.222 . . . . 0.0 110.719 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 125.043 1.337 . . . . 0.0 109.875 178.926 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.981 0 CA-C-O 119.767 -0.463 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -144.48 121.5 11.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.62 1.168 . . . . 0.0 109.195 178.133 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 115.85 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 125.145 1.378 . . . . 0.0 109.119 -176.204 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.7 p -73.74 163.05 28.49 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 124.109 0.964 . . . . 0.0 111.081 173.079 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.36 -41.03 68.67 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.64 0.376 . . . . 0.0 110.016 177.494 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -57.98 -51.33 70.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.716 0.806 . . . . 0.0 110.914 177.269 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.1 -44.76 96.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.779 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -52.11 -41.79 62.74 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.747 0.819 . . . . 0.0 111.317 177.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -52.79 -35.53 56.79 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.8 0.727 . . . . 0.0 112.009 176.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.0 t -57.62 -40.6 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 118.439 0.563 . . . . 0.0 110.104 175.042 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.0 tp -66.28 -45.65 79.73 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.824 -0.547 . . . . 0.0 109.624 172.292 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 CA--C 1.536 0.405 0 CA-C-N 118.347 0.521 . . . . 0.0 111.284 -178.032 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.437 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.07 -50.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.519 2.146 . . . . 0.0 112.376 176.463 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.25 -44.67 94.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.136 0.574 . . . . 0.0 110.981 -179.233 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -57.69 -51.15 70.71 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.107 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.7 mt -62.38 -42.17 99.21 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.336 0.654 . . . . 0.0 109.761 -178.072 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -55.01 -51.05 67.47 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.371 0.532 . . . . 0.0 110.766 171.301 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -55.68 26.11 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.46 -59.15 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 C-N-CA 123.907 0.883 . . . . 0.0 109.288 176.43 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -47.28 -55.18 9.19 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.911 1.284 . . . . 0.0 109.741 -179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -57.57 -47.45 82.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.59 0.756 . . . . 0.0 111.076 -176.984 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.83 -48.85 79.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.775 -178.465 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -57.04 -59.68 4.71 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.348 0.594 . . . . 0.0 111.064 174.021 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.9 -51.46 13.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.889 2.076 . . . . 0.0 112.154 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.234 0 C-N-CA 123.631 0.772 . . . . 0.0 112.401 177.014 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 . . . . . 0 CA--C 1.551 1.007 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.8 117.03 32.97 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.865 2.066 . . . . 0.0 111.412 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.3 m -65.49 159.49 24.31 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.022 1.283 . . . . 0.0 111.02 169.094 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 59.3 mtmt -37.99 -53.27 1.37 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.341 1.456 . . . . 0.0 112.867 177.263 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mp0 -65.71 -31.45 72.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 119.5 -0.286 . . . . 0.0 110.406 -175.821 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -73.77 -43.53 58.73 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.346 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.66 -45.96 77.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.566 0.746 . . . . 0.0 109.358 173.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -60.47 -49.05 79.09 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 121.407 -0.808 . . . . 0.0 110.685 173.866 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.99 -60.8 2.47 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 123.548 0.739 . . . . 0.0 111.164 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.251 1.4 pt? -70.94 -33.61 70.66 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.384 -172.123 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -65.43 -42.63 92.26 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.344 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -58.24 -50.34 73.92 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.919 1.236 . . . . 0.0 110.856 173.061 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -62.2 -56.71 15.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 110.498 -173.712 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -84.25 -35.48 23.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.336 1.054 . . . . 0.0 111.604 -170.0 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 123.84 0.856 . . . . 0.0 112.028 -169.881 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.5 tp . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -55.97 -51.15 68.72 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -178.688 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.53 -54.83 33.97 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.168 0.587 . . . . 0.0 109.731 -178.098 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.4 tp -51.43 -58.15 7.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 27.1 t80 -54.86 -43.98 73.57 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.23 1.012 . . . . 0.0 111.214 -179.204 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -57.59 -44.57 85.47 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.199 0.454 . . . . 0.0 111.048 179.537 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -72.02 -43.9 64.28 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 -179.079 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.432 HD11 HD12 ' A' ' 69' ' ' LEU . 2.4 tt -62.04 -59.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.427 1.491 . . . . 0.0 110.253 -176.325 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -78.28 65.28 3.59 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -178.252 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.6 pttm . . . . . 0 CA--C 1.534 0.35 0 C-N-CA 123.324 0.65 . . . . 0.0 111.483 -179.641 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.894 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -164.92 134.38 3.62 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -173.349 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.443 HG23 ' CE2' ' A' ' 50' ' ' PHE . 55.8 t -88.58 103.73 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 126.623 1.969 . . . . 0.0 108.776 -168.085 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.61 152.82 37.81 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.634 1.174 . . . . 0.0 109.193 175.089 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -51.01 -33.79 26.46 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.74 0.7 . . . . 0.0 111.731 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -55.59 -53.13 60.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.189 0.996 . . . . 0.0 110.584 173.106 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -62.57 -43.28 99.2 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -58.43 -44.65 89.22 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 122.048 -0.407 . . . . 0.0 111.028 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -57.96 -37.48 74.26 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.193 -0.942 . . . . 0.0 111.635 176.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.53 -38.99 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.439 -0.788 . . . . 0.0 109.802 172.089 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.432 HD12 HD11 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -55.7 -50.93 68.97 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.652 -0.655 . . . . 0.0 109.75 169.443 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 CA--C 1.53 0.198 0 C-N-CA 123.549 0.74 . . . . 0.0 110.801 -179.569 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.825 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.36 -43.93 46.46 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.356 2.038 . . . . 0.0 112.439 176.054 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.26 -43.75 73.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.189 0.596 . . . . 0.0 109.925 -177.682 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -56.73 -52.26 65.67 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.31 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.7 mt -60.48 -42.12 95.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.992 0.517 . . . . 0.0 109.87 -178.009 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -56.08 -51.51 67.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.293 0.497 . . . . 0.0 110.627 172.534 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.92 37.96 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 9' ' ' ILE . 69.5 mt -50.36 -60.9 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 123.63 0.772 . . . . 0.0 109.047 175.196 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.4 -57.11 4.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.07 1.348 . . . . 0.0 110.576 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.27 -47.86 77.76 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 111.765 179.676 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -59.08 -44.25 91.87 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.997 -0.439 . . . . 0.0 111.784 179.619 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -63.91 -56.26 16.62 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.808 0.731 . . . . 0.0 111.381 173.125 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.97 -46.25 2.77 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.229 1.812 . . . . 0.0 112.68 178.178 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 174.541 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.528 HD22 ' HB3' ' A' ' 27' ' ' GLU . 70.3 mt -111.5 123.01 49.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.15 1.38 . . . . 0.0 109.891 -175.099 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -84.44 168.96 15.03 Favored 'General case' 0 C--N 1.335 -0.058 0 CA-C-N 120.431 1.468 . . . . 0.0 109.476 168.927 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -38.48 -47.84 1.32 Allowed 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 126.152 1.781 . . . . 0.0 110.743 178.365 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -51.69 -55.44 19.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.296 0.638 . . . . 0.0 111.513 176.145 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.528 ' HB3' HD22 ' A' ' 23' ' ' LEU . 16.1 mp0 -62.43 -44.77 95.64 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.595 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.26 -47.67 84.47 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.765 -0.159 . . . . 0.0 110.86 -173.234 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -55.36 -55.45 31.38 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 121.211 -0.931 . . . . 0.0 109.531 173.999 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 tp -51.84 -55.32 20.72 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.718 1.261 . . . . 0.0 110.416 -172.599 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 0.8 OUTLIER -75.35 -32.82 61.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 118.539 -0.743 . . . . 0.0 111.793 -175.487 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.16 -44.25 76.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 120.266 1.394 . . . . 0.0 110.854 178.898 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -51.59 68.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.109 174.6 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 51.5 m -66.3 -52.51 46.57 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 121.163 -0.215 . . . . 0.0 111.279 -171.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.581 0.752 . . . . 0.0 111.347 -170.772 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -169.492 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.24 -43.38 74.54 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.243 0.929 . . . . 0.0 110.422 178.095 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.95 -58.68 4.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.298 0.639 . . . . 0.0 109.472 175.157 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -50.15 -50.03 50.26 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.851 0.86 . . . . 0.0 110.628 -174.531 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -51.32 -39.8 57.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.847 1.659 . . . . 0.0 111.053 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -61.32 -35.26 76.91 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 117.908 0.322 . . . . 0.0 110.727 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.19 -44.94 18.92 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.17 -56.52 20.72 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.022 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -79.86 65.73 5.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.711 0.804 . . . . 0.0 109.87 -172.596 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? . . . . . 0 CA--C 1.536 0.426 0 C-N-CA 124.078 0.951 . . . . 0.0 112.018 176.7 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.44 0 N-CA-C 108.254 -1.939 . . . . 0.0 108.254 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -157.98 154.03 27.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 126.901 2.081 . . . . 0.0 107.745 -169.508 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.7 t -117.98 112.92 40.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 125.681 1.592 . . . . 0.0 108.037 -172.95 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.6 p -67.52 162.55 23.05 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 123.185 0.594 . . . . 0.0 110.611 175.556 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -54.34 -37.45 64.92 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.608 0.718 . . . . 0.0 110.478 169.592 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -59.46 -56.79 17.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.933 0.893 . . . . 0.0 110.084 177.542 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -59.93 -42.01 93.04 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.433 0.635 . . . . 0.0 110.046 179.163 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -54.74 -47.73 73.46 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 177.114 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.64 -28.27 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.602 -0.686 . . . . 0.0 112.408 178.09 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.4 t -64.24 -50.97 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 169.348 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.43 -39.18 69.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.175 -0.328 . . . . 0.0 111.539 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.0 t . . . . . 0 CA--C 1.536 0.427 0 C-N-CA 124.529 1.132 . . . . 0.0 111.825 175.252 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.13 -43.09 61.52 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.122 1.881 . . . . 0.0 112.231 174.25 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.85 -40.69 83.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.351 0.661 . . . . 0.0 109.669 -178.727 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.68 -53.02 61.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.526 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.19 -37.69 86.27 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.437 -178.96 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -56.42 -50.71 70.84 Favored 'General case' 0 CA--C 1.527 0.07 0 CA-C-N 118.681 0.673 . . . . 0.0 110.296 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.69 -52.85 45.65 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 178.418 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 9' ' ' ILE . 53.8 mt -52.78 -60.1 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.721 0.808 . . . . 0.0 109.362 177.407 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -46.86 -54.35 10.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.699 1.2 . . . . 0.0 109.863 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.13 -51.36 69.6 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.158 0.983 . . . . 0.0 110.679 -178.109 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -58.33 -47.66 83.05 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.913 -0.492 . . . . 0.0 111.557 -179.175 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.411 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.3 m-85 -54.0 -62.17 1.83 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.33 0.586 . . . . 0.0 110.967 171.468 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.54 -45.0 46.95 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.335 -174.887 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.323 0 C-N-CA 123.692 0.797 . . . . 0.0 112.486 177.74 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.537 0.444 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.1 mt -101.88 124.97 48.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.58 1.152 . . . . 0.0 111.111 -176.288 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 86.5 p -63.55 164.47 9.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.358 0.981 . . . . 0.0 108.982 167.746 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 4.9 ptpp? -52.32 -38.28 58.13 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.078 -1.014 . . . . 0.0 112.473 169.337 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.39 -49.92 74.95 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.371 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -63.15 -41.92 99.35 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 122.218 -0.302 . . . . 0.0 111.242 178.959 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.94 -43.61 94.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.33 1.052 . . . . 0.0 109.154 178.866 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -55.91 -58.53 7.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.398 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.27 -60.45 2.12 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.353 1.061 . . . . 0.0 111.561 -173.192 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 13' ' ' TYR . 1.4 pt? -67.35 -33.12 74.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.775 -174.944 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.88 -37.43 86.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.073 174.142 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -63.21 -48.99 75.97 Favored 'General case' 0 CA--C 1.527 0.067 0 CA-C-N 120.206 1.366 . . . . 0.0 109.25 176.913 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -63.76 -55.57 22.14 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.037 -173.343 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -86.43 -36.08 19.31 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.995 0.918 . . . . 0.0 111.787 -169.962 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 123.756 0.822 . . . . 0.0 112.213 -169.233 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 tp . . . . . 0 C--O 1.224 -0.265 0 CA-C-O 119.588 -0.244 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -57.21 -54.05 51.14 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.057 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.7 -55.61 18.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.002 -177.21 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tt -49.65 -56.09 11.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.623 1.169 . . . . 0.0 109.678 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.491 ' CE1' HG23 ' A' ' 61' ' ' VAL . 37.2 t80 -58.45 -46.45 86.54 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.197 -0.43 . . . . 0.0 110.76 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -42.7 89.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.589 0.632 . . . . 0.0 111.316 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -70.12 -50.16 43.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.685 0.755 . . . . 0.0 109.611 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.45 -55.05 39.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.471 1.508 . . . . 0.0 109.603 -178.018 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -80.64 46.35 0.86 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.071 1.348 . . . . 0.0 112.245 -169.362 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 pttt . . . . . 0 CA--C 1.533 0.306 0 C-N-CA 126.68 1.992 . . . . 0.0 114.048 -171.394 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -138.99 127.01 22.38 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.499 1.119 . . . . 0.0 110.14 179.178 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.491 HG23 ' CE1' ' A' ' 50' ' ' PHE . 32.9 t -88.48 117.82 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 124.746 1.218 . . . . 0.0 110.345 -177.438 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.2 m -80.89 155.77 26.37 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.54 1.136 . . . . 0.0 110.849 172.383 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -55.54 -33.38 63.77 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.077 0.465 . . . . 0.0 112.091 -178.911 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.55 -47.5 69.96 Favored 'General case' 0 C--O 1.227 -0.092 0 O-C-N 121.592 -0.693 . . . . 0.0 110.714 172.26 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -72.79 -41.26 65.19 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.05 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -53.7 -43.92 69.37 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.981 -0.449 . . . . 0.0 110.494 177.827 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -57.4 -30.79 65.23 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.745 -0.597 . . . . 0.0 112.571 177.406 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.6 t -61.17 -39.83 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.245 0.93 . . . . 0.0 109.63 171.01 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -46.87 84.52 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.312 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.7 t . . . . . 0 CA--C 1.536 0.439 0 O-C-N 121.339 -0.851 . . . . 0.0 111.659 177.812 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.7 tptt . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.903 -0.036 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -51.46 59.48 Favored Pre-proline 0 N--CA 1.452 -0.335 0 CA-C-O 118.006 -0.997 . . . . 0.0 112.934 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.54 -48.04 22.11 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.975 1.783 . . . . 0.0 111.965 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.02 -47.65 76.7 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 123.328 0.651 . . . . 0.0 110.08 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -56.72 -50.19 72.94 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 mt -67.05 -37.01 83.29 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.225 0.61 . . . . 0.0 109.752 -175.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -60.32 -47.74 84.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.294 0.497 . . . . 0.0 110.525 172.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -56.18 -55.63 28.4 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -47.65 -63.92 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.657 1.183 . . . . 0.0 109.15 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -43.38 -55.73 3.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.503 1.521 . . . . 0.0 110.777 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.73 -48.59 79.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.956 0.903 . . . . 0.0 110.682 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -60.02 -47.4 86.0 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.048 -0.408 . . . . 0.0 111.009 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.36 -55.89 28.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.211 0.459 . . . . 0.0 110.977 174.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.481 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.88 -53.25 6.23 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.391 1.076 . . . . 0.0 112.013 178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.8 -32.8 3.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -58.1 -33.68 69.36 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 111.161 177.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.12 18.57 3.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.334 1.054 . . . . 0.0 111.31 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.46 -61.79 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -178.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -55.34 111.05 2.63 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 124.017 0.927 . . . . 0.0 109.25 176.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.17 -13.88 28.55 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 122.104 1.869 . . . . 0.0 112.545 -173.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -121.4 22.42 10.75 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 118.493 -0.765 . . . . 0.0 112.967 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.481 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -156.35 140.99 16.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -174.656 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 mt -111.95 110.13 20.28 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.049 1.34 . . . . 0.0 111.01 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 m -62.84 159.96 15.55 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.411 -0.805 . . . . 0.0 109.42 167.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 1.2 mptp? -38.61 -50.56 1.61 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 124.305 1.042 . . . . 0.0 112.849 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.62 -41.15 98.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.469 0.176 . . . . 0.0 111.329 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -68.54 -44.79 73.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.88 -52.89 63.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -50.47 -56.27 12.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.153 0.581 . . . . 0.0 109.848 175.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -58.65 -45.91 88.27 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.867 1.267 . . . . 0.0 109.014 -169.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.597 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.2 tt -59.02 -55.45 34.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.79 -37.2 70.8 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.114 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.8 -51.85 66.59 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 119.285 0.948 . . . . 0.0 109.125 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -66.91 -51.76 51.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.416 -172.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -77.86 -40.56 39.74 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.541 0.737 . . . . 0.0 111.629 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -133.74 62.6 59.42 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 123.765 0.826 . . . . 0.0 112.859 -169.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -39.24 -36.24 0.82 Allowed 'Trans proline' 0 C--N 1.349 0.562 1 C-N-CA 125.894 4.396 . . . . 0.0 117.977 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 p -98.46 -19.62 17.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.572 1.549 . . . . 0.0 112.545 -173.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.8 -39.63 85.61 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.269 0.94 . . . . 0.0 110.539 -171.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.586 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -61.17 -21.4 63.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? 62.98 -65.8 0.1 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.576 1.95 . . . . 0.0 112.661 -175.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -151.65 133.49 4.22 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 108.01 -2.036 . . . . 0.0 108.01 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.5 mmt -34.38 -54.26 0.52 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.371 1.869 . . . . 0.0 114.185 -169.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -44.41 -40.26 5.31 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 113.106 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -52.6 -25.72 11.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.509 1.124 . . . . 0.0 111.747 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.4 tp -49.25 -38.91 28.39 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.538 0.735 . . . . 0.0 110.573 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -55.92 -55.39 33.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.174 0.511 . . . . 0.0 110.356 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.09 -50.72 63.09 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.11 -57.09 12.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.827 0.851 . . . . 0.0 109.162 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.476 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.6 t80 -59.69 -43.52 94.03 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 118.072 0.396 . . . . 0.0 110.558 -179.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.97 -43.7 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.12 0.418 . . . . 0.0 111.1 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.71 -53.57 13.09 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.39 0.614 . . . . 0.0 109.548 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.26 -59.71 4.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.103 2.161 . . . . 0.0 109.738 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -81.08 45.15 0.81 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.527 0.731 . . . . 0.0 112.401 -169.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -49.08 67.13 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.068 0.947 . . . . 0.0 111.688 -169.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.83 13.86 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.107 0.563 . . . . 0.0 111.231 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.61 -34.88 56.26 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.918 -169.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 66.43 -57.67 0.37 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.806 2.042 . . . . 0.0 113.849 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.21 -51.33 3.77 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 124.472 1.034 . . . . 0.0 111.635 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -127.21 139.27 53.05 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.388 1.475 . . . . 0.0 109.261 -172.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.93 111.02 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 124.943 1.297 . . . . 0.0 107.784 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -75.95 166.54 23.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -57.34 -32.22 66.51 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.32 0.581 . . . . 0.0 110.956 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -53.94 -55.49 26.57 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.866 0.866 . . . . 0.0 110.244 172.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -65.99 -41.27 91.3 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -56.01 -43.18 77.47 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.808 -0.557 . . . . 0.0 111.204 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -56.18 -30.21 61.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.531 -0.731 . . . . 0.0 112.039 176.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.8 -42.63 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.336 0.971 . . . . 0.0 110.283 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.65 -47.01 88.15 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.59 -42.94 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.546 -0.721 . . . . 0.0 111.499 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -57.5 -26.74 61.76 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.407 -0.808 . . . . 0.0 112.127 175.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -76.69 -53.12 8.41 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.931 0.787 . . . . 0.0 110.106 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -33.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 118.542 0.61 . . . . 0.0 111.656 -175.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.4 m 76.25 -44.16 0.48 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.595 1.958 . . . . 0.0 112.453 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.251 1.18 0 CA-C-O 117.413 -1.28 . . . . 0.0 110.479 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -53.91 -48.17 94.61 Favored Pre-proline 0 N--CA 1.451 -0.386 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.216 -175.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.87 -48.04 23.48 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.817 1.678 . . . . 0.0 111.976 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.5 mp0 -65.73 -46.6 78.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.487 0.715 . . . . 0.0 110.141 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -57.8 -49.0 78.11 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mp -67.84 -33.01 73.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.523 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.25 -50.29 74.25 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.093 0.86 . . . . 0.0 110.175 169.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.97 -56.96 18.3 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.504 -1.039 . . . . 0.0 110.504 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.9 mt -44.16 -64.98 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.783 1.633 . . . . 0.0 110.01 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -43.14 -54.34 4.49 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.687 1.195 . . . . 0.0 109.662 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -59.1 -53.51 57.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.904 0.882 . . . . 0.0 111.448 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -63.65 -33.2 75.11 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 119.935 -0.706 . . . . 0.0 112.033 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -65.79 -60.62 2.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.853 0.752 . . . . 0.0 110.972 170.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' N ' ' A' ' 22' ' ' GLN . . . -43.9 -41.02 4.92 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 125.614 1.565 . . . . 0.0 112.747 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -42.62 -36.18 1.32 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 174.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -74.19 -27.43 60.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.113 0.869 . . . . 0.0 112.058 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.31 157.6 35.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.213 1.005 . . . . 0.0 110.546 -176.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -46.49 -49.3 15.84 Favored Glycine 0 CA--C 1.529 0.957 0 C-N-CA 123.808 0.718 . . . . 0.0 111.717 176.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -93.62 117.98 67.4 Favored Pre-proline 0 CA--C 1.533 0.313 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 168.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.95 1.32 5.99 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.534 2.156 . . . . 0.0 114.57 -170.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -125.74 33.62 5.06 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.902 1.228 . . . . 0.0 110.8 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.401 ' N ' ' HB1' ' A' ' 14' ' ' ALA . 2.0 tt0 -145.74 149.91 35.27 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.434 0.693 . . . . 0.0 110.206 -176.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.5 mt -115.94 107.77 15.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.894 0.878 . . . . 0.0 109.949 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.6 t -72.82 166.15 23.49 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 120.113 1.324 . . . . 0.0 109.718 169.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -38.78 -45.75 1.18 Allowed 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.742 1.617 . . . . 0.0 112.168 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.48 -48.54 81.24 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.056 0.389 . . . . 0.0 111.401 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.97 -40.95 75.08 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.24 -47.57 85.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.528 1.131 . . . . 0.0 108.993 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -59.2 -48.73 80.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.123 -0.985 . . . . 0.0 110.573 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.8 tp -52.36 -58.66 5.99 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 121.965 -0.46 . . . . 0.0 110.954 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.261 1.2 pt? -71.8 -33.86 68.91 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.12 -175.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.05 -42.79 93.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.169 1.35 . . . . 0.0 110.325 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -56.27 -53.82 52.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 119.499 1.045 . . . . 0.0 110.695 170.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -64.28 -51.52 63.09 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.413 -170.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -81.33 -40.15 24.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.165 0.986 . . . . 0.0 111.526 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -129.69 64.73 72.86 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.213 1.005 . . . . 0.0 111.631 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.69 71.72 1.46 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 124.115 3.21 . . . . 0.0 112.144 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.2 p -170.63 -73.55 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.829 0.852 . . . . 0.0 110.646 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 pp -51.91 -36.51 49.21 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.03 1.332 . . . . 0.0 114.479 -167.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.638 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.66 -30.24 68.61 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 177.344 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.528 ' N ' HD22 ' A' ' 40' ' ' LEU 0.343 19.2 ptpt 49.02 -56.75 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 129.296 3.039 . . . . 0.0 117.289 -173.419 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.73 162.33 34.45 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 120.135 1.334 . . . . 0.0 110.987 -176.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -56.91 -42.96 80.9 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.23 1.012 . . . . 0.0 111.644 -173.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 p -52.47 -59.27 4.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.792 0.837 . . . . 0.0 109.69 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.2 m -58.02 -38.16 75.68 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 119.017 -0.515 . . . . 0.0 111.429 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tt -58.87 -40.88 85.66 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 118.909 0.777 . . . . 0.0 109.379 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -56.96 -49.92 74.23 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 110.783 176.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -62.82 -55.09 29.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.331 0.586 . . . . 0.0 109.988 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.0 tp -48.95 -53.24 20.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.41 1.084 . . . . 0.0 109.361 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.36 -47.18 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.03 0.932 . . . . 0.0 110.659 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -55.96 -45.1 78.98 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.129 0.422 . . . . 0.0 110.922 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.27 -41.52 80.95 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.168 0.587 . . . . 0.0 110.851 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.48 -56.56 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 127.251 2.22 . . . . 0.0 109.51 -174.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.63 51.0 1.4 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.674 1.59 . . . . 0.0 111.832 -169.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -50.32 -45.6 54.94 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.617 1.167 . . . . 0.0 113.049 -169.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -90.48 -48.39 7.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.184 0.594 . . . . 0.0 110.785 -176.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.4 -35.91 59.64 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-O 119.3 -0.722 . . . . 0.0 112.387 -171.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.6 t0 34.16 54.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.506 1.922 . . . . 0.0 112.851 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.67 -50.79 0.21 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -137.44 132.13 32.95 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.068 0.947 . . . . 0.0 110.266 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.0 t -87.93 114.36 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 125.676 1.59 . . . . 0.0 109.167 -175.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.5 m -79.3 159.84 27.05 Favored 'General case' 0 C--N 1.335 -0.063 0 C-N-CA 123.823 0.849 . . . . 0.0 110.819 174.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -53.12 -33.79 53.86 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.478 0.656 . . . . 0.0 111.646 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 mp0 -56.26 -47.35 78.75 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.006 0.922 . . . . 0.0 110.144 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -75.67 -36.08 60.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -58.45 -42.38 87.25 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.61 -0.681 . . . . 0.0 110.33 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -57.15 -33.97 67.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.61 -1.306 . . . . 0.0 111.898 172.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.8 t -63.24 -45.73 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.402 1.001 . . . . 0.0 109.463 171.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.5 tp -51.3 -45.35 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.498 0.59 . . . . 0.0 110.42 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t -55.98 -38.35 52.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.845 0.748 . . . . 0.0 111.227 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -58.67 -32.85 69.48 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.292 -0.88 . . . . 0.0 111.497 174.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -73.41 -55.81 5.88 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -29.22 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 O-C-N 121.852 -0.53 . . . . 0.0 111.254 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.9 m 78.23 -46.88 0.44 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 127.103 2.161 . . . . 0.0 111.616 173.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.251 173.085 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? . . . . . 0 N--CA 1.474 0.775 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.98 -50.94 81.31 Favored Pre-proline 0 N--CA 1.452 -0.35 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.09 -169.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -52.2 -46.17 34.49 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.088 1.859 . . . . 0.0 111.861 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.02 -44.87 79.19 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.764 0.826 . . . . 0.0 110.031 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.13 -50.88 71.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -65.27 -38.56 90.67 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.269 0.628 . . . . 0.0 110.106 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -56.32 -54.51 44.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 170.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.9 -55.09 22.56 Favored Glycine 0 CA--C 1.529 0.908 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.46 -61.5 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.342 1.057 . . . . 0.0 109.521 175.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -45.16 -53.6 7.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.395 1.078 . . . . 0.0 110.654 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -60.85 -48.39 82.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.338 0.655 . . . . 0.0 110.539 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.53 -44.72 93.12 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.893 0.315 . . . . 0.0 111.04 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -58.29 -62.48 1.8 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.758 0.254 . . . . 0.0 110.829 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.48 -52.24 6.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.154 1.382 . . . . 0.0 112.092 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -45.47 -32.98 2.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 114.245 -177.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 ptpp? -66.42 -22.01 66.22 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 120.535 1.516 . . . . 0.0 111.525 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -87.84 19.68 3.41 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.204 1.002 . . . . 0.0 111.183 172.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.22 -61.87 3.78 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -61.37 115.22 13.58 Favored Pre-proline 0 CA--C 1.537 0.453 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.27 -22.91 33.65 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 121.957 1.771 . . . . 0.0 111.467 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -110.11 48.68 0.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.917 0.887 . . . . 0.0 111.07 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.26 143.73 3.66 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 169.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -119.11 116.64 26.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.983 1.713 . . . . 0.0 109.978 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 95.7 p -63.11 169.52 3.38 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.024 -1.047 . . . . 0.0 110.204 169.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -45.73 -43.2 12.68 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.37 -0.832 . . . . 0.0 111.365 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.18 -47.69 73.14 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.226 -0.296 . . . . 0.0 110.412 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.94 -41.74 99.59 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.853 -0.529 . . . . 0.0 109.977 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.5 -49.74 76.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.571 1.548 . . . . 0.0 110.129 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -62.38 -40.77 97.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.121 175.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.9 -57.2 13.55 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 121.531 -0.731 . . . . 0.0 111.098 -178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.4 pt? -69.4 -35.79 76.12 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 119.229 -0.988 . . . . 0.0 112.113 -176.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.86 -40.73 95.6 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 119.453 1.024 . . . . 0.0 110.676 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -57.21 -52.19 66.33 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.468 1.031 . . . . 0.0 110.954 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -61.25 -56.05 25.02 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 110.698 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -83.31 -36.6 24.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.502 1.121 . . . . 0.0 111.799 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -130.05 60.95 55.54 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 123.678 0.791 . . . . 0.0 112.247 -172.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.23 75.55 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 124.576 3.518 . . . . 0.0 111.934 -174.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 m 173.59 -42.93 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 129.068 2.947 . . . . 0.0 108.684 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -82.55 50.6 1.68 Allowed 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.216 -0.927 . . . . 0.0 111.639 -171.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -169.33 40.66 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.968 1.307 . . . . 0.0 110.985 -178.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -70.25 77.3 0.53 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.479 -0.763 . . . . 0.0 113.0 -169.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 132.04 129.3 3.01 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 124.958 1.266 . . . . 0.0 111.453 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 44.2 tpp -56.94 -37.03 70.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.002 0.521 . . . . 0.0 109.83 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.8 p -59.59 -64.53 0.91 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.24 1.016 . . . . 0.0 109.101 169.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -44.05 -35.78 2.26 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.419 1.888 . . . . 0.0 113.146 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp -49.34 -42.79 42.79 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.419 0.687 . . . . 0.0 110.134 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.23 -50.67 68.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.597 0.359 . . . . 0.0 110.414 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.3 mp0 -66.69 -50.24 63.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.3 tt -50.57 -57.98 6.89 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -52.65 -50.73 62.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.258 1.023 . . . . 0.0 110.928 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -54.53 -42.44 70.89 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.848 0.749 . . . . 0.0 111.611 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -72.04 -20.04 61.74 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.52 0.328 . . . . 0.0 111.607 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -90.75 -58.59 2.43 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.922 1.289 . . . . 0.0 110.206 -176.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -78.81 43.32 0.49 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.513 1.925 . . . . 0.0 113.311 -167.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -79.89 58.1 2.78 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.178 0.991 . . . . 0.0 111.852 -169.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 177.43 -54.06 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 127.182 2.193 . . . . 0.0 107.934 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.85 -34.41 77.34 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.8 t70 68.64 -59.7 0.45 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 126.721 2.008 . . . . 0.0 113.243 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.2 -37.32 6.73 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.58 1.086 . . . . 0.0 112.295 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -138.11 138.49 38.75 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.778 0.831 . . . . 0.0 110.222 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.7 t -88.72 116.61 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 C-N-CA 127.106 2.162 . . . . 0.0 109.826 -172.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.9 p -70.13 168.32 15.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.742 0.817 . . . . 0.0 111.471 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -60.92 -35.56 77.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.596 0.713 . . . . 0.0 109.676 169.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -58.9 -51.99 67.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.005 0.922 . . . . 0.0 109.094 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -65.98 -40.18 91.01 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.359 0.599 . . . . 0.0 110.247 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -60.4 -34.0 73.29 Favored 'General case' 0 C--O 1.216 -0.697 0 O-C-N 121.375 -0.828 . . . . 0.0 111.479 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.6 -35.06 73.58 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.03 -1.669 . . . . 0.0 111.703 170.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.5 t -62.75 -42.39 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 121.038 -1.039 . . . . 0.0 108.739 169.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.51 -43.49 68.34 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.403 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.418 ' HA ' HG12 ' A' ' 73' ' ' ILE . 61.6 t -55.88 -45.14 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 120.139 1.336 . . . . 0.0 110.289 177.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.7 -50.55 71.83 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.997 -0.439 . . . . 0.0 110.165 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -58.47 -47.92 82.45 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.418 HG12 ' HA ' ' A' ' 70' ' ' VAL . 30.3 pt -64.57 -28.61 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.489 -0.757 . . . . 0.0 110.868 176.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m 57.93 46.0 17.34 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.542 1.137 . . . . 0.0 111.443 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 117.723 -1.132 . . . . 0.0 109.312 -178.901 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.61 -50.08 61.43 Favored Pre-proline 0 N--CA 1.451 -0.395 0 C-N-CA 124.05 0.94 . . . . 0.0 113.221 -170.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.68 -47.81 19.65 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 121.783 1.656 . . . . 0.0 112.323 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -69.62 -43.33 72.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.862 0.465 . . . . 0.0 110.332 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -54.69 -54.46 41.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.086 0.47 . . . . 0.0 109.775 177.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.07 -34.46 76.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.621 -177.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -57.78 -50.12 74.31 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 119.67 1.123 . . . . 0.0 110.558 172.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.23 -53.84 41.67 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 23.4 mt -49.45 -62.27 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -45.99 -57.18 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.007 1.323 . . . . 0.0 111.165 -177.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -66.13 -36.2 82.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.326 -0.369 . . . . 0.0 111.215 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -63.5 -49.21 74.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.672 0.669 . . . . 0.0 110.005 176.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -57.8 -52.65 64.58 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.717 -0.615 . . . . 0.0 111.363 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.61 -57.74 3.95 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.031 0.532 . . . . 0.0 110.626 172.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.45 -34.42 64.47 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.23 0.612 . . . . 0.0 112.626 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -66.84 -35.89 81.08 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.188 0.904 . . . . 0.0 110.155 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -64.18 -50.48 67.95 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 149.27 -49.0 0.58 Allowed Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -60.37 129.94 89.39 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.98 -13.76 41.12 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.094 1.863 . . . . 0.0 114.03 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -159.83 38.79 0.19 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.697 1.135 . . . . 0.0 113.569 -176.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -152.06 135.31 15.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.855 -0.528 . . . . 0.0 111.128 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.6 mt -109.2 108.93 19.74 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.809 1.244 . . . . 0.0 110.532 -173.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.4 t -70.79 165.8 22.35 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 119.43 1.014 . . . . 0.0 110.698 169.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 59.3 mtmt -38.24 -51.22 1.47 Allowed 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 126.222 1.809 . . . . 0.0 112.378 -176.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.0 mp0 -65.41 -39.44 92.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.77 -0.157 . . . . 0.0 110.709 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.74 -42.0 74.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.53 -48.68 80.06 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.574 -0.158 . . . . 0.0 110.574 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.85 -52.17 66.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.301 -0.874 . . . . 0.0 109.433 177.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 tp -51.28 -60.34 3.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 123.349 0.406 . . . . 0.0 110.363 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.281 0.9 OUTLIER -69.94 -32.33 70.54 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 119.126 -1.03 . . . . 0.0 112.467 -173.435 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.81 -44.95 84.1 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 119.962 1.255 . . . . 0.0 110.48 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -48.53 80.46 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.99 0.359 . . . . 0.0 110.289 176.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -64.81 -53.47 46.4 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.428 0.156 . . . . 0.0 110.695 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -83.8 -41.21 17.8 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.237 0.615 . . . . 0.0 111.432 -171.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -121.17 56.78 5.94 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.55 0.614 . . . . 0.0 111.962 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -64.48 149.7 89.54 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.13 1.887 . . . . 0.0 110.05 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 t 75.18 -40.08 0.42 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.562 1.545 . . . . 0.0 112.565 174.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.0 tp -51.22 -38.38 52.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.415 0.552 . . . . 0.0 109.575 170.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.33 166.46 17.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.088 0.955 . . . . 0.0 109.77 168.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -131.62 76.22 1.7 Allowed 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.75 55.47 3.81 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.145 0.878 . . . . 0.0 113.365 -169.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -87.61 -122.86 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -47.45 -42.05 21.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.073 0.949 . . . . 0.0 111.268 173.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.32 -33.96 1.79 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.868 2.067 . . . . 0.0 113.089 175.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.0 tp -51.03 -39.61 56.29 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.446 0.698 . . . . 0.0 109.759 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.36 -53.55 52.44 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 118.258 0.481 . . . . 0.0 110.562 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.17 -49.6 64.12 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -55.61 -52.68 62.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 19.1 t80 -57.78 -44.71 86.4 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.533 0.733 . . . . 0.0 110.419 178.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.35 -41.07 88.37 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.069 0.395 . . . . 0.0 111.149 178.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -68.85 -46.6 68.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.671 0.748 . . . . 0.0 109.272 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.77 -54.77 8.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.324 1.45 . . . . 0.0 110.672 -170.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.55 48.23 1.03 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.514 1.126 . . . . 0.0 112.886 -168.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -48.51 -48.29 38.29 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.429 1.491 . . . . 0.0 112.694 -169.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.15 -45.63 6.79 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.704 0.802 . . . . 0.0 110.702 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.08 88.81 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 118.166 -1.352 . . . . 0.0 113.527 -170.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.2 t0 0.34 75.1 0.0 OUTLIER 'General case' 0 C--N 1.347 0.479 0 C-N-CA 129.152 2.981 . . . . 0.0 114.261 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.04 -46.09 0.68 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 108.431 -1.867 . . . . 0.0 108.431 -169.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -151.77 135.72 16.49 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 112.11 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.2 t -88.08 116.13 29.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 127.269 2.228 . . . . 0.0 110.335 -168.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 89.4 p -67.59 164.69 18.54 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.151 0.98 . . . . 0.0 111.075 175.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -58.92 -37.67 77.19 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.22 0.533 . . . . 0.0 110.368 170.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -56.52 -54.82 41.41 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.193 0.597 . . . . 0.0 110.26 175.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -61.49 -43.43 98.88 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.035 0.445 . . . . 0.0 110.013 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.49 -41.74 77.15 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 122.058 -0.401 . . . . 0.0 111.002 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -58.31 -27.6 64.24 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.119 -0.988 . . . . 0.0 112.345 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.72 -43.02 97.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.633 1.106 . . . . 0.0 109.497 170.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -58.99 -46.75 87.39 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 172.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.93 -41.86 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 O-C-N 120.998 -1.064 . . . . 0.0 111.176 175.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -56.97 -32.76 66.38 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.647 -0.658 . . . . 0.0 111.013 175.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.0 -52.55 14.0 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.464 0.574 . . . . 0.0 110.35 172.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.3 -34.08 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.878 0.763 . . . . 0.0 111.712 -175.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.8 m 67.3 36.6 3.89 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.238 1.415 . . . . 0.0 112.148 172.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.903 171.631 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 120.675 0.274 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -58.01 22.78 Favored Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-O 118.35 -0.833 . . . . 0.0 112.642 -177.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -56.59 -37.33 97.76 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 CA-C-N 120.881 1.35 . . . . 0.0 111.241 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -64.86 -51.54 61.46 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 122.654 0.381 . . . . 0.0 110.904 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -65.66 -38.89 90.59 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.451 -0.781 . . . . 0.0 109.11 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.13 -30.73 71.28 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.254 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -59.32 -46.51 88.38 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 120.346 1.43 . . . . 0.0 109.321 169.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.97 -56.8 16.94 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.5 mt -50.02 -63.18 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 123.391 0.676 . . . . 0.0 109.637 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -43.01 -52.79 5.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.423 1.889 . . . . 0.0 110.675 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.4 -50.57 73.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.221 1.009 . . . . 0.0 110.376 -178.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -60.57 -40.39 91.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.126 -0.359 . . . . 0.0 111.449 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -61.55 -60.8 3.15 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.321 0.509 . . . . 0.0 111.811 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.47 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -40.77 -53.8 2.77 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.924 1.29 . . . . 0.0 111.613 177.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.05 -28.9 4.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.682 1.193 . . . . 0.0 113.673 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -60.36 -29.34 68.85 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 119.229 0.922 . . . . 0.0 111.012 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -88.07 14.8 8.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.087 0.955 . . . . 0.0 112.014 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.45 -54.71 3.66 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 121.069 -1.02 . . . . 0.0 111.021 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -49.46 119.53 9.4 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 123.834 0.854 . . . . 0.0 109.5 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -71.83 -20.64 25.8 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.024 1.816 . . . . 0.0 112.547 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -148.76 53.74 0.99 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.91 0.777 . . . . 0.0 110.977 -168.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.47 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 1.2 tt0 -161.42 141.15 10.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 121.725 -0.61 . . . . 0.0 111.611 171.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 73.4 mt -115.48 108.12 16.06 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.107 1.363 . . . . 0.0 110.311 -178.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -63.63 159.5 18.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.166 -0.959 . . . . 0.0 109.749 168.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -39.18 -46.83 1.53 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.616 1.166 . . . . 0.0 113.071 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -61.09 -43.95 98.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 117.761 0.255 . . . . 0.0 111.389 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -68.69 -42.42 77.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.46 -47.34 85.86 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -56.79 -50.28 72.81 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.484 -0.76 . . . . 0.0 109.709 175.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -53.03 -57.34 10.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.656 0.382 . . . . 0.0 111.627 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.0 OUTLIER -73.44 -33.63 65.02 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 119.286 0.948 . . . . 0.0 112.472 -176.79 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.18 -38.74 92.37 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 120.691 1.587 . . . . 0.0 109.387 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.2 tm0? -61.24 -50.8 71.59 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.956 -0.465 . . . . 0.0 111.413 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -68.57 -47.68 66.19 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.788 -171.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -88.65 -39.52 13.98 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.334 1.053 . . . . 0.0 111.466 -170.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -127.39 58.52 31.52 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.742 0.701 . . . . 0.0 112.689 -171.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.31 72.15 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 124.534 3.489 . . . . 0.0 111.661 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.1 m -178.84 -35.69 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 128.709 2.804 . . . . 0.0 109.515 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.46 -42.08 79.26 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.801 0.81 . . . . 0.0 110.198 -170.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.59 64.63 0.11 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.61 1.964 . . . . 0.0 112.285 178.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -65.62 77.66 0.07 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 111.678 -177.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.56 133.55 8.06 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -174.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 66.6 mtt -61.78 -55.11 33.58 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 122.423 -0.457 . . . . 0.0 109.922 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -46.14 33.58 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.0 1.32 . . . . 0.0 111.255 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.51 -26.81 3.72 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.788 1.635 . . . . 0.0 112.821 179.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.29 -34.3 68.55 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.438 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -55.28 -54.39 44.09 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.279 0.945 . . . . 0.0 110.505 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mp0 -65.8 -50.81 63.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.41 0.684 . . . . 0.0 109.708 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.7 tp -51.96 -55.59 19.44 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -53.45 -49.07 68.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.119 1.368 . . . . 0.0 110.728 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -53.89 -43.3 69.54 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.735 0.243 . . . . 0.0 111.282 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -76.09 -43.42 43.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 111.277 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 tt -55.48 -56.15 23.58 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.776 1.63 . . . . 0.0 109.435 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -80.24 45.8 0.78 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.098 1.359 . . . . 0.0 113.209 -168.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -77.92 60.67 2.37 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 122.029 0.919 . . . . 0.0 111.137 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -172.26 -55.0 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 126.383 1.873 . . . . 0.0 108.102 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.05 -35.33 24.49 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 41.01 50.43 3.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.251 1.82 . . . . 0.0 112.1 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 168.96 -45.51 0.22 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 -174.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -135.17 133.01 38.69 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.74 1.216 . . . . 0.0 108.448 173.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 29.4 t -86.88 112.33 22.88 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.8 p -78.67 162.19 26.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.547 0.739 . . . . 0.0 109.857 172.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -54.7 -31.61 58.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.311 0.577 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -51.43 -55.97 15.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.819 0.848 . . . . 0.0 110.543 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -72.98 -35.18 66.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -56.85 -42.82 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.698 -0.626 . . . . 0.0 110.663 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.07 -34.43 68.27 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.072 -1.017 . . . . 0.0 111.812 174.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.2 t -61.38 -42.83 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.432 1.014 . . . . 0.0 109.386 172.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.5 -45.99 80.75 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.673 -0.642 . . . . 0.0 109.882 171.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -41.2 67.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.097 -1.002 . . . . 0.0 111.378 175.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -58.27 -26.11 62.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.422 -0.798 . . . . 0.0 111.696 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -77.34 -53.74 7.32 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.853 0.752 . . . . 0.0 110.045 170.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -35.97 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.572 0.624 . . . . 0.0 111.657 -174.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.7 m 63.63 43.44 5.73 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.885 1.274 . . . . 0.0 111.984 173.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.253 1.272 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.835 177.538 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.769 -0.086 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -47.84 -47.29 63.11 Favored Pre-proline 0 N--CA 1.453 -0.293 0 CA-C-O 117.663 -1.161 . . . . 0.0 113.895 -171.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.13 -52.76 8.3 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 121.914 1.743 . . . . 0.0 112.385 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -73.58 -39.39 64.69 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.591 0.356 . . . . 0.0 110.606 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.78 -54.4 44.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.448 ' CD2' HD11 ' A' ' 73' ' ' ILE . 9.2 mp -71.54 -28.04 63.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.86 -175.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.9 -51.2 70.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.437 1.017 . . . . 0.0 108.781 168.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.47 -54.84 27.89 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 176.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.02 -61.27 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.849 0.859 . . . . 0.0 109.789 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -45.88 -54.54 8.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.24 1.416 . . . . 0.0 110.244 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.95 -43.71 98.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -64.76 -43.16 94.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.614 1.097 . . . . 0.0 111.638 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.8 -57.36 12.35 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.299 0.954 . . . . 0.0 111.098 171.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.72 -51.26 7.28 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.322 1.049 . . . . 0.0 111.883 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.74 -29.82 29.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -32.06 71.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.615 1.098 . . . . 0.0 110.505 174.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -87.91 21.44 2.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.35 1.46 . . . . 0.0 110.777 173.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.22 -62.23 3.4 Favored Glycine 0 CA--C 1.528 0.854 0 O-C-N 120.792 -1.192 . . . . 0.0 111.575 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.03 122.92 66.52 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 117.39 0.595 . . . . 0.0 109.671 -177.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.88 -10.31 24.65 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.188 1.925 . . . . 0.0 113.576 -172.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -143.59 42.08 1.47 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.541 1.064 . . . . 0.0 112.012 -176.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.485 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 46.1 tt0 -152.08 139.44 19.46 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.287 -0.883 . . . . 0.0 111.42 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.8 mt -119.57 131.99 55.64 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.814 1.246 . . . . 0.0 110.099 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.4 p -72.92 172.6 10.62 Favored 'General case' 0 C--O 1.224 -0.277 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 167.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -57.03 -33.26 67.01 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 121.072 -1.018 . . . . 0.0 112.26 168.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -65.16 -53.33 46.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.458 0.572 . . . . 0.0 110.134 174.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -61.6 -39.85 92.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.75 -47.69 84.65 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.349 0.659 . . . . 0.0 110.263 175.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -55.57 -48.45 74.78 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.305 -0.872 . . . . 0.0 109.679 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.31 -66.62 0.37 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.578 0.751 . . . . 0.0 110.065 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.265 1.2 pt? -70.21 -29.94 66.91 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.573 -172.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -66.75 -44.5 81.3 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 120.516 1.507 . . . . 0.0 110.581 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.54 -49.39 76.89 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.311 0.505 . . . . 0.0 110.262 174.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.3 m -65.97 -50.89 62.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.171 -173.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -84.41 -40.67 17.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.843 0.857 . . . . 0.0 111.657 -173.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -121.32 61.26 10.72 Favored Pre-proline 0 CA--C 1.542 0.653 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.594 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -22.04 79.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.774 1 C-N-CA 127.685 5.59 . . . . 0.0 117.61 -175.543 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 m 47.86 33.85 3.56 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 112.849 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.16 -43.38 64.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.496 1.118 . . . . 0.0 108.987 171.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.774 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -95.82 22.21 7.59 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 126.035 1.734 . . . . 0.0 111.694 178.628 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? 68.06 -54.67 0.51 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 127.373 2.269 . . . . 0.0 112.749 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.63 -61.44 3.24 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 74.8 mtm -47.46 112.01 0.49 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.515 1.126 . . . . 0.0 109.781 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.6 m 64.68 -61.96 0.2 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.832 2.053 . . . . 0.0 111.888 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -37.05 -33.97 0.07 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 129.321 3.048 . . . . 0.0 114.342 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.8 tp -48.17 -41.0 25.77 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 123.544 0.738 . . . . 0.0 110.246 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.55 -58.93 4.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.148 0.499 . . . . 0.0 110.41 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.94 -49.99 70.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.965 0.506 . . . . 0.0 109.737 -175.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -51.57 -55.0 21.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.763 0.825 . . . . 0.0 108.906 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.2 t80 -56.58 -47.39 79.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.645 0.778 . . . . 0.0 110.992 178.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.42 -40.31 86.29 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.543 0.61 . . . . 0.0 111.284 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 68.0 tt0 -68.91 -45.99 69.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.688 0.756 . . . . 0.0 109.269 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.54 -51.51 55.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.554 1.542 . . . . 0.0 110.591 -175.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -74.49 72.35 1.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.725 1.21 . . . . 0.0 109.548 -174.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -52.15 -36.49 51.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.156 1.382 . . . . 0.0 111.506 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.19 -20.01 63.98 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.79 34.11 81.02 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -171.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.15 -4.2 59.07 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.947 0.499 . . . . 0.0 111.927 -174.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.18 16.21 75.03 Favored Glycine 0 CA--C 1.531 1.088 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -169.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -154.14 155.72 35.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.948 1.699 . . . . 0.0 107.326 -169.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.8 t -125.2 113.37 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.063 1.345 . . . . 0.0 109.016 -175.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.2 p -69.93 168.09 16.05 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 124.339 1.056 . . . . 0.0 110.857 170.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -56.49 -42.02 77.59 Favored 'General case' 0 C--N 1.342 0.246 0 O-C-N 121.865 -0.522 . . . . 0.0 109.961 169.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -58.89 -49.44 77.77 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.23 0.612 . . . . 0.0 109.585 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.36 -45.99 92.08 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.195 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -52.98 -40.55 63.83 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 122.05 -0.406 . . . . 0.0 111.094 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -55.39 -31.87 62.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.212 -0.93 . . . . 0.0 111.844 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.8 t -64.2 -35.11 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.473 -0.767 . . . . 0.0 110.168 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -66.36 -45.21 80.89 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.475 -0.765 . . . . 0.0 109.143 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t -54.02 -41.3 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.086 0.403 . . . . 0.0 110.813 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -53.47 -34.58 58.48 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.513 -0.742 . . . . 0.0 112.34 172.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -76.45 -52.64 9.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.719 0.691 . . . . 0.0 110.684 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.448 HD11 ' CD2' ' A' ' 6' ' ' LEU . 0.8 OUTLIER -59.93 -35.19 59.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 121.092 0.472 . . . . 0.0 110.974 -177.006 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 t 69.55 -66.25 0.27 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 127.115 2.166 . . . . 0.0 111.229 -173.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 116.413 -1.755 . . . . 0.0 109.798 -168.686 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -48.23 -56.41 14.25 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.636 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -44.64 -40.28 13.93 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.838 2.359 . . . . 0.0 114.163 171.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -71.66 -41.26 68.95 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.178 0.444 . . . . 0.0 109.823 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.57 -51.3 69.11 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.08 -39.3 85.61 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.661 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.48 -51.81 67.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 119.009 0.822 . . . . 0.0 110.443 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.12 -54.56 30.92 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.2 mt -49.78 -63.07 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -43.45 -57.24 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.149 1.38 . . . . 0.0 111.007 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.48 -36.66 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.767 -174.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -62.08 -47.54 84.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.26 0.482 . . . . 0.0 110.786 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -58.43 -55.45 34.89 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.594 0.634 . . . . 0.0 111.008 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -54.26 7.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.617 0.767 . . . . 0.0 111.515 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.52 -28.88 9.3 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 178.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 119.951 1.251 . . . . 0.0 111.107 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -102.81 29.25 5.5 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.149 0.58 . . . . 0.0 110.522 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.18 -47.82 3.24 Favored Glycine 0 CA--C 1.53 0.977 0 O-C-N 121.12 -0.988 . . . . 0.0 112.421 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -39.69 115.18 1.03 Allowed Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.304 . . . . 0.0 111.734 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -69.97 -35.82 11.33 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 121.603 1.535 . . . . 0.0 110.326 178.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -137.34 68.91 1.41 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.825 0.85 . . . . 0.0 109.733 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -173.75 142.96 0.95 Allowed 'General case' 0 C--N 1.343 0.315 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 169.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -117.24 109.03 16.37 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.41 1.484 . . . . 0.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.1 m -59.75 156.06 14.73 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.856 0.753 . . . . 0.0 109.1 167.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -45.87 -39.89 9.22 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -72.96 -34.02 66.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.02 0.827 . . . . 0.0 111.529 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.88 -49.23 73.52 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 174.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.72 -48.67 77.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.888 -0.507 . . . . 0.0 109.928 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -53.59 -57.67 9.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.133 0.424 . . . . 0.0 110.716 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.26 -33.56 69.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' C ' ' A' ' 31' ' ' LEU . 3.5 tt -56.64 -59.09 5.51 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 169.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -54.66 -42.93 71.92 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.413 -0.805 . . . . 0.0 111.538 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -62.4 -49.7 74.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.432 0.56 . . . . 0.0 110.115 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.0 m -69.51 -48.94 58.91 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.932 0.396 . . . . 0.0 110.023 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -81.85 -41.23 21.31 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 118.318 -0.849 . . . . 0.0 111.742 -169.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -112.4 73.86 1.45 Allowed Pre-proline 0 CA--C 1.541 0.63 0 CA-C-N 119.273 0.942 . . . . 0.0 112.018 -170.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -61.17 158.71 33.57 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.47 2.113 . . . . 0.0 109.537 172.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.5 m 66.79 -41.12 0.39 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.402 1.481 . . . . 0.0 113.973 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.0 mp -76.5 -40.36 50.37 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.21 0.914 . . . . 0.0 109.63 -172.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.39 9.56 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 178.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -79.4 65.52 4.59 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.979 1.263 . . . . 0.0 109.749 -170.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 177.31 65.39 0.06 OUTLIER Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -175.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -67.53 -57.93 5.62 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.852 0.461 . . . . 0.0 109.959 -173.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.9 p -54.64 -44.6 73.35 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.659 0.742 . . . . 0.0 109.79 171.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.51 -13.19 0.87 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.663 1.585 . . . . 0.0 113.188 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp -48.61 -40.04 26.12 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.426 1.012 . . . . 0.0 109.379 169.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -54.17 -53.44 53.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.983 0.42 . . . . 0.0 110.6 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -63.95 -53.59 47.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -51.67 -55.79 17.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.023 0.529 . . . . 0.0 109.714 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 16.9 t80 -55.66 -47.86 75.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.835 0.854 . . . . 0.0 110.754 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -56.42 -39.99 73.97 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.025 0.375 . . . . 0.0 111.932 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -49.07 17.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 109.937 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 tt -62.26 -56.81 14.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.932 1.693 . . . . 0.0 109.615 -174.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -80.87 43.61 0.7 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.965 0.906 . . . . 0.0 112.293 -169.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -61.99 -32.98 73.5 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -168.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.13 -47.52 8.03 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 122.802 0.441 . . . . 0.0 110.698 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.97 -39.23 54.88 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 119.604 -0.553 . . . . 0.0 111.866 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 t0 42.52 53.21 4.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.364 1.466 . . . . 0.0 112.136 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.74 -55.22 0.2 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -134.64 141.1 46.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.038 0.935 . . . . 0.0 109.548 173.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.407 HG23 ' CE1' ' A' ' 50' ' ' PHE . 35.5 t -88.55 120.36 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 C-N-CA 125.209 1.404 . . . . 0.0 109.529 -176.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -71.86 163.47 27.77 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 123.946 0.898 . . . . 0.0 111.107 172.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -58.52 -35.13 71.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.861 0.838 . . . . 0.0 109.876 170.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.77 -51.68 68.3 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.439 1.096 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.36 -44.5 94.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.95 0.405 . . . . 0.0 110.123 174.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -53.96 -44.3 70.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.399 0.68 . . . . 0.0 110.889 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -55.03 -31.3 60.97 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.34 -0.85 . . . . 0.0 112.396 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.57 -37.8 79.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 119.013 0.824 . . . . 0.0 110.262 172.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.37 -50.27 70.59 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.2 t -53.51 -42.91 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 117.86 0.3 . . . . 0.0 111.071 -177.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -51.89 -34.57 41.87 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.197 0.599 . . . . 0.0 111.58 176.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -82.09 -49.8 9.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.984 0.514 . . . . 0.0 110.591 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -35.58 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.101 0.864 . . . . 0.0 111.25 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m 73.06 -57.92 0.62 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.945 2.098 . . . . 0.0 112.139 173.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.145 -1.407 . . . . 0.0 111.825 178.57 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.4 tptm . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 121.727 0.775 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.3 -53.13 18.78 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 125.713 1.605 . . . . 0.0 112.685 -174.12 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -49.67 -49.62 15.35 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.367 2.045 . . . . 0.0 112.786 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.05 -39.24 79.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.497 0.319 . . . . 0.0 110.585 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.86 -52.29 65.7 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 174.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 23.3 mt -63.75 -39.58 94.63 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.283 1.033 . . . . 0.0 110.569 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -58.15 -52.86 63.8 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.243 0.617 . . . . 0.0 110.4 172.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.3 -55.14 28.06 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.4 mt -43.62 -64.83 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.028 1.331 . . . . 0.0 109.455 171.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -45.59 -53.29 9.34 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.61 1.164 . . . . 0.0 110.7 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.51 -48.61 80.97 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.903 0.481 . . . . 0.0 110.977 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.96 -43.45 95.04 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 122.004 -0.435 . . . . 0.0 111.167 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -62.02 -58.44 7.84 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 111.081 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.444 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.17 -53.07 5.24 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.102 0.961 . . . . 0.0 111.928 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.8 -27.9 8.23 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.376 1.071 . . . . 0.0 113.646 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -60.93 -28.72 69.15 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.555 1.071 . . . . 0.0 110.809 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -93.08 21.06 6.13 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.37 1.068 . . . . 0.0 111.284 174.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.31 -59.31 3.64 Favored Glycine 0 CA--C 1.528 0.854 0 O-C-N 121.327 -0.858 . . . . 0.0 111.291 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -55.03 116.98 12.67 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.544 0.737 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.82 -19.95 30.42 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.995 1.797 . . . . 0.0 112.115 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -129.4 58.19 1.63 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.295 0.638 . . . . 0.0 111.914 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.444 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -171.69 140.2 1.3 Allowed 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 167.608 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.4 mt -112.02 119.04 37.12 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.814 1.646 . . . . 0.0 109.622 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -61.91 169.19 2.71 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.834 1.197 . . . . 0.0 109.752 168.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -52.24 -36.96 53.87 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.004 -1.06 . . . . 0.0 111.875 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.24 -51.06 63.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.16 -41.94 97.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.48 -48.63 80.25 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.867 1.267 . . . . 0.0 109.605 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 tttp -58.38 -51.16 70.99 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -49.03 -61.99 1.77 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.339 1.055 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.277 1.0 OUTLIER -68.09 -32.73 73.25 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.322 -175.036 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -63.39 -46.77 84.9 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 119.925 1.238 . . . . 0.0 110.449 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -56.09 -52.37 64.55 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.025 173.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.0 m -66.52 -47.97 71.23 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.039 -170.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -87.56 -41.55 13.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.576 0.75 . . . . 0.0 111.981 -172.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -114.57 84.0 9.45 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 118.67 0.668 . . . . 0.0 110.671 -169.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -60.13 166.0 9.72 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 121.995 1.797 . . . . 0.0 110.694 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.4 m 70.98 -50.78 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.105 1.362 . . . . 0.0 112.444 -172.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.2 mt -54.22 -42.75 70.17 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.023 0.829 . . . . 0.0 111.441 -173.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.458 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -55.99 -11.06 0.93 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 178.109 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.6 tttp -52.98 -34.75 57.43 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.288 0.949 . . . . 0.0 109.846 169.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -73.54 62.73 1.89 Allowed Glycine 0 CA--C 1.533 1.21 0 N-CA-C 110.641 -0.983 . . . . 0.0 110.641 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 52.2 ttm -67.12 -72.39 0.17 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.649 0.779 . . . . 0.0 110.118 -170.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -54.16 -37.14 64.11 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.483 0.713 . . . . 0.0 110.489 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -17.41 1.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.635 1.574 . . . . 0.0 112.841 176.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.7 tp -46.13 -41.2 12.14 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.656 1.116 . . . . 0.0 110.041 170.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -53.55 -55.55 24.59 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.354 0.597 . . . . 0.0 110.937 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.01 -49.07 63.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.483 0.713 . . . . 0.0 109.45 -174.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.07 -59.13 4.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.698 0.799 . . . . 0.0 108.976 177.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -56.85 -43.68 81.4 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.032 0.533 . . . . 0.0 110.804 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.51 -42.75 78.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.037 0.38 . . . . 0.0 111.19 176.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -71.12 -38.38 72.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.189 0.596 . . . . 0.0 110.174 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.87 -51.21 42.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.934 1.694 . . . . 0.0 110.406 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -78.76 66.95 4.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.016 0.927 . . . . 0.0 109.38 -169.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -70.11 67.71 0.3 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.719 2.007 . . . . 0.0 109.997 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 176.83 -36.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 127.66 2.384 . . . . 0.0 108.465 -172.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.57 40.29 86.19 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -73.07 -18.83 61.28 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 122.667 -0.313 . . . . 0.0 110.604 176.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.85 0.73 90.4 Favored Glycine 0 CA--C 1.531 1.082 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -142.93 163.14 33.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.553 1.941 . . . . 0.0 107.017 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.4 t -119.59 115.71 48.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 125.988 1.715 . . . . 0.0 108.243 -173.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.8 p -81.1 163.71 22.95 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 124.238 1.015 . . . . 0.0 110.565 176.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -55.07 -32.95 62.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.119 0.485 . . . . 0.0 111.025 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.99 -34.25 77.15 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.015 0.926 . . . . 0.0 112.069 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -82.74 -42.09 18.43 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -57.6 -44.04 85.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.816 0.846 . . . . 0.0 111.262 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -60.48 -24.67 65.46 Favored 'General case' 0 CA--C 1.529 0.137 0 O-C-N 120.754 -1.216 . . . . 0.0 112.427 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.31 -48.14 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 C-N-CA 119.747 -0.781 . . . . 0.0 108.919 170.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -48.81 -42.48 36.16 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.129 -0.357 . . . . 0.0 110.447 172.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 78.0 t -53.34 -36.71 27.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.0 111.792 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.65 -29.84 70.93 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.249 -0.907 . . . . 0.0 110.79 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -78.46 -49.16 13.94 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.035 0.934 . . . . 0.0 110.111 177.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.3 pt -63.0 -37.06 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-N 118.475 0.579 . . . . 0.0 111.171 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.5 p 65.82 -57.7 0.33 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 112.722 -172.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 . . . . . 0 C--O 1.251 1.183 0 C-N-CA 126.064 1.746 . . . . 0.0 112.76 179.304 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 52.2 tptt . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 120.338 0.113 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.74 -55.01 45.42 Favored Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.896 -169.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.89 -48.96 14.75 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.563 2.176 . . . . 0.0 112.38 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.86 -46.49 84.75 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.812 0.845 . . . . 0.0 110.184 -178.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -57.5 -48.26 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.4 mt -63.24 -39.73 95.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.735 0.814 . . . . 0.0 110.449 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -54.86 -53.17 58.86 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.517 0.727 . . . . 0.0 109.826 170.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.06 -55.7 26.81 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.0 mt -46.8 -61.25 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 124.302 1.041 . . . . 0.0 109.114 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -46.63 -56.8 5.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.637 0.775 . . . . 0.0 110.964 -178.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -55.04 -47.12 75.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.72 0.408 . . . . 0.0 111.605 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -59.81 -47.18 86.76 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.948 -0.47 . . . . 0.0 111.023 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -61.59 -53.94 49.54 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 118.487 0.585 . . . . 0.0 110.933 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.99 -52.92 8.3 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.302 0.641 . . . . 0.0 112.02 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.33 -20.84 1.19 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.38 -32.44 70.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.668 1.122 . . . . 0.0 111.192 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -95.98 -175.1 3.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.423 0.689 . . . . 0.0 110.556 176.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -58.33 -53.36 46.41 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 123.465 0.555 . . . . 0.0 112.677 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -84.07 117.28 68.29 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 117.809 0.805 . . . . 0.0 109.642 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -74.39 5.01 3.94 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.533 2.155 . . . . 0.0 113.938 -174.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.47 38.56 1.26 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.344 0.975 . . . . 0.0 111.571 174.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.28 145.98 29.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 122.191 -0.318 . . . . 0.0 110.704 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -114.76 108.35 16.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.377 0.671 . . . . 0.0 110.342 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.7 t -65.77 161.55 20.61 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 168.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 67.4 mttm -38.66 -51.08 1.66 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.625 1.17 . . . . 0.0 113.042 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -66.79 -41.49 87.56 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.63 -42.94 95.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.0 tp -56.2 -61.78 2.16 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 172.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -46.59 -46.15 19.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.538 1.063 . . . . 0.0 111.732 -178.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.4 -29.36 68.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.676 1.19 . . . . 0.0 109.741 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.553 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.3 tt -79.32 -58.65 3.11 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 174.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.95 -60.94 1.96 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.928 2.091 . . . . 0.0 111.914 -170.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.18 -46.63 79.29 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -177.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -65.69 -49.61 67.9 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 111.704 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -83.03 -36.09 25.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.08 -171.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -124.56 61.1 27.99 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.583 0.753 . . . . 0.0 110.685 -173.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.08 65.7 5.17 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.054 3.169 . . . . 0.0 111.978 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.1 m -160.53 -68.48 0.07 Allowed 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.095 0.958 . . . . 0.0 110.284 174.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.6 tp -78.32 60.64 2.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.404 0.681 . . . . 0.0 110.799 -169.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.558 HD12 ' H ' ' A' ' 41' ' ' LYS . 0.6 OUTLIER -179.04 -44.79 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.265 1.026 . . . . 0.0 112.114 -173.078 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.558 ' H ' HD12 ' A' ' 40' ' ' LEU . 2.8 tmtm? 61.15 -68.31 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.036 1.734 . . . . 0.0 110.445 -168.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 118.99 101.63 2.0 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 124.795 1.188 . . . . 0.0 111.577 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.1 pmm? -164.29 -150.85 0.15 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.776 1.63 . . . . 0.0 107.077 170.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.1 p -46.18 -32.26 2.88 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.183 1.793 . . . . 0.0 112.74 176.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 m -47.1 -28.19 1.66 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.738 1.615 . . . . 0.0 112.92 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp -51.39 -45.2 62.41 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 118.174 0.443 . . . . 0.0 109.921 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -60.29 -46.23 90.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -176.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.39 -54.85 40.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.1 tp -50.36 -55.84 13.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.968 0.507 . . . . 0.0 109.749 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 12.5 t80 -51.16 -48.48 61.85 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.101 0.961 . . . . 0.0 111.074 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.08 -44.52 94.72 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.367 0.53 . . . . 0.0 111.241 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.85 -36.77 80.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.301 0.64 . . . . 0.0 110.814 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.36 -56.81 4.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.985 1.714 . . . . 0.0 109.774 -173.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -80.17 48.75 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.933 1.693 . . . . 0.0 112.605 -168.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -56.0 -39.23 71.58 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -170.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.63 -48.11 7.79 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.857 0.463 . . . . 0.0 110.8 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.51 -36.22 44.56 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.228 -0.762 . . . . 0.0 112.314 -171.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 37.8 t0 34.83 56.49 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.386 1.874 . . . . 0.0 112.552 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 166.16 -46.68 0.27 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -173.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -136.36 129.25 31.02 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.633 1.173 . . . . 0.0 109.246 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.37 115.05 27.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -84.23 156.44 22.0 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.994 1.318 . . . . 0.0 109.99 178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -55.23 -31.94 61.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.477 0.656 . . . . 0.0 111.985 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -57.01 -43.97 82.36 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.868 0.867 . . . . 0.0 110.555 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -77.63 -38.71 47.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -59.78 -37.4 78.97 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 121.676 -0.64 . . . . 0.0 110.715 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -56.59 -34.1 66.86 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.303 -1.498 . . . . 0.0 112.117 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -64.09 -44.76 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.283 0.947 . . . . 0.0 109.022 170.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -51.75 -41.82 61.88 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.799 -0.563 . . . . 0.0 110.558 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.53 -36.36 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 119.339 0.972 . . . . 0.0 111.615 178.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -64.64 -48.21 75.67 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.81 -0.556 . . . . 0.0 109.588 174.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -61.97 -46.66 88.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.3 pt -63.74 -30.59 50.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.893 0.769 . . . . 0.0 110.045 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.1 m 64.2 49.91 2.51 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 125.648 1.579 . . . . 0.0 109.726 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.483 -1.722 . . . . 0.0 111.62 -170.577 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.7 -48.35 91.1 Favored Pre-proline 0 N--CA 1.451 -0.414 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.276 -169.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.4 -47.24 28.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.016 1.811 . . . . 0.0 112.046 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -68.04 -43.28 79.06 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.625 0.77 . . . . 0.0 110.02 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.36 -52.02 64.89 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.551 0.74 . . . . 0.0 109.239 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.5 mt -64.25 -37.35 87.18 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.236 0.614 . . . . 0.0 110.427 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -57.96 -48.28 80.42 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.597 0.635 . . . . 0.0 110.312 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.9 -55.56 27.21 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 177.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -50.21 -62.21 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.721 0.808 . . . . 0.0 109.417 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -43.25 -54.53 4.5 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 125.032 1.333 . . . . 0.0 110.443 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.2 -46.82 88.91 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.253 1.021 . . . . 0.0 110.449 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.71 -45.7 93.2 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.226 -0.296 . . . . 0.0 110.927 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -58.14 -58.79 6.89 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.075 0.398 . . . . 0.0 111.396 173.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.77 -53.04 7.82 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.318 1.447 . . . . 0.0 111.724 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.41 -31.41 9.58 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -58.32 -33.0 69.01 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.27 0.941 . . . . 0.0 111.121 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -100.45 38.84 1.44 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.189 0.519 . . . . 0.0 109.996 172.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.94 -69.8 2.4 Favored Glycine 0 CA--C 1.524 0.648 0 O-C-N 121.453 -0.779 . . . . 0.0 111.229 173.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.65 103.45 0.37 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.161 -174.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -64.69 -22.37 64.32 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.126 1.884 . . . . 0.0 110.855 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -88.82 1.31 55.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.059 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 117.453 2.39 . . . . 0.0 117.453 -168.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 59.7 mt -111.23 126.22 54.64 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.3 1.44 . . . . 0.0 110.467 176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.5 p -71.99 171.32 12.05 Favored 'General case' 0 C--O 1.224 -0.249 0 O-C-N 121.307 -0.87 . . . . 0.0 109.513 169.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -47.85 -45.3 30.01 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.104 0.866 . . . . 0.0 111.207 168.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.16 -52.04 65.41 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -61.2 -42.18 98.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.292 0.568 . . . . 0.0 110.361 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.92 -48.95 79.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.77 1.628 . . . . 0.0 109.691 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -59.56 -47.67 84.64 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.343 -0.848 . . . . 0.0 110.272 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.9 tp -52.09 -59.79 3.95 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.016 0.926 . . . . 0.0 111.208 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.3 pt? -68.77 -34.86 76.28 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.82 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.41 -43.45 94.35 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.628 1.104 . . . . 0.0 110.679 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -55.27 -53.98 49.23 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 119.639 1.109 . . . . 0.0 110.466 172.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -65.38 -54.24 31.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.014 -169.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -81.43 -37.63 27.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.475 0.71 . . . . 0.0 111.728 -174.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -131.07 63.24 69.59 Favored Pre-proline 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 112.549 -168.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.45 74.71 0.38 Allowed 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.204 3.269 . . . . 0.0 112.692 -173.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -168.67 -60.34 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.168 1.787 . . . . 0.0 108.843 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.77 49.44 1.05 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.309 1.043 . . . . 0.0 112.743 -169.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.427 HD13 ' N ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -165.83 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.146 1.378 . . . . 0.0 112.953 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -77.65 69.42 3.89 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.442 -0.786 . . . . 0.0 110.556 -172.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -174.96 93.45 0.09 OUTLIER Glycine 0 CA--C 1.526 0.749 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 95.9 mmm -49.98 -55.29 15.2 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.26 1.024 . . . . 0.0 111.001 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 p -61.33 -55.81 27.49 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.298 1.039 . . . . 0.0 109.576 174.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -48.07 -31.38 5.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.005 1.722 . . . . 0.0 113.205 -176.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp -49.51 -43.29 45.36 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.4 0.68 . . . . 0.0 109.733 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.26 -50.16 72.12 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.539 0.336 . . . . 0.0 110.323 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.08 -53.39 50.4 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.468 0.707 . . . . 0.0 109.892 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.3 tp -50.43 -57.72 7.36 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.541 0.736 . . . . 0.0 109.254 178.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -52.73 -48.87 66.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.957 0.903 . . . . 0.0 111.322 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -55.92 -46.13 78.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.538 0.608 . . . . 0.0 111.209 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -71.14 -40.6 71.26 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 121.025 0.441 . . . . 0.0 110.593 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.64 -55.89 25.76 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.305 1.442 . . . . 0.0 109.442 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -80.81 51.72 1.58 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.184 1.794 . . . . 0.0 111.85 -169.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -49.64 -44.09 47.27 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.371 1.069 . . . . 0.0 113.412 -169.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.05 -48.33 7.04 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.144 0.577 . . . . 0.0 110.888 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.72 -35.32 55.2 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.643 -170.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.3 t0 31.59 56.48 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.792 2.037 . . . . 0.0 113.055 -175.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.03 -48.75 0.22 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -134.0 127.96 33.39 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.736 1.214 . . . . 0.0 108.946 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.7 t -87.26 114.14 25.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 125.236 1.414 . . . . 0.0 108.694 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.5 m -77.75 154.31 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -48.24 -41.01 26.4 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.446 0.641 . . . . 0.0 111.571 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -64.46 -36.09 83.06 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.067 0.547 . . . . 0.0 110.601 -177.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -74.75 -44.7 48.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -51.37 -40.62 59.59 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.496 0.718 . . . . 0.0 110.474 174.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -55.37 -32.93 63.0 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.647 -0.658 . . . . 0.0 111.903 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.57 -41.85 91.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.186 -0.946 . . . . 0.0 109.719 172.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.09 -44.32 97.53 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.5 t -54.53 -40.28 49.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -53.35 -43.55 67.81 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.264 0.938 . . . . 0.0 110.474 173.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -70.92 -40.6 72.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.406 0.682 . . . . 0.0 112.209 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 pt -65.16 -39.96 87.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.56 1.073 . . . . 0.0 109.777 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.8 m 72.18 -48.71 0.68 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.938 2.095 . . . . 0.0 114.193 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 117.641 -1.171 . . . . 0.0 110.141 -168.833 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -49.37 69.34 Favored Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-O 118.057 -0.973 . . . . 0.0 113.589 -169.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.17 -46.8 21.43 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.814 1.676 . . . . 0.0 112.061 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -72.34 -38.53 68.58 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.801 0.441 . . . . 0.0 110.646 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.72 -55.36 33.12 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.998 -0.438 . . . . 0.0 110.013 174.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.69 -33.53 76.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.3 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -56.9 -50.72 71.67 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.261 0.937 . . . . 0.0 110.517 170.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.65 -52.32 49.04 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -51.95 -62.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.775 0.83 . . . . 0.0 109.519 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -42.47 -55.47 3.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.643 1.177 . . . . 0.0 110.179 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -57.86 -52.45 65.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.904 0.881 . . . . 0.0 111.752 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -62.11 -38.66 89.75 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.769 -0.772 . . . . 0.0 111.72 -176.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -61.98 -60.56 3.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.595 0.634 . . . . 0.0 111.189 169.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.91 -48.14 16.23 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.609 1.564 . . . . 0.0 113.498 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.35 -29.12 1.54 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.859 1.264 . . . . 0.0 113.41 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -57.86 -33.77 69.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.066 0.848 . . . . 0.0 111.29 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -91.03 25.14 2.54 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.443 0.697 . . . . 0.0 111.529 173.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.81 -64.03 3.06 Favored Glycine 0 CA--C 1.526 0.735 0 O-C-N 121.206 -0.934 . . . . 0.0 110.962 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -60.72 111.26 3.82 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 117.65 0.725 . . . . 0.0 109.756 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -67.74 -18.32 47.67 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 121.699 1.6 . . . . 0.0 111.48 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -106.16 35.96 2.75 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.018 0.927 . . . . 0.0 111.013 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -160.5 136.08 8.14 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 116.738 2.125 . . . . 0.0 116.738 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.8 mt -113.81 123.12 49.05 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.169 1.788 . . . . 0.0 110.234 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.9 p -66.0 167.23 10.13 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.1 -1.0 . . . . 0.0 110.147 169.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.513 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 60.2 mtpt -43.56 -47.56 7.39 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.38 -0.825 . . . . 0.0 111.709 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -67.25 -46.84 72.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -176.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -62.02 -44.99 95.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.197 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.58 -49.42 77.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.15 -53.8 38.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.934 0.788 . . . . 0.0 110.084 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.28 -51.15 71.17 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.265 1.026 . . . . 0.0 108.531 -170.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.552 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.9 tt -56.58 -55.77 29.74 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.135 -1.393 . . . . 0.0 108.378 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.79 -40.75 73.13 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.981 0.809 . . . . 0.0 111.227 -177.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.7 -49.78 73.73 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.218 0.917 . . . . 0.0 109.076 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.5 m -66.35 -51.51 56.43 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.709 -173.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -83.9 -41.64 17.2 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.259 1.024 . . . . 0.0 111.535 -172.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -125.38 61.55 35.83 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.145 0.978 . . . . 0.0 111.78 -170.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.06 72.28 2.1 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.646 2.897 . . . . 0.0 111.253 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.6 p -174.79 -65.4 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 124.747 1.219 . . . . 0.0 109.337 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.6 mt -50.3 -31.51 14.53 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.676 1.59 . . . . 0.0 114.102 -169.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.584 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.52 -18.44 61.65 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 179.157 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.422 ' N ' HD22 ' A' ' 40' ' ' LEU 0.362 0.0 OUTLIER 51.45 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 128.5 2.72 . . . . 0.0 114.478 -168.993 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -125.06 168.31 17.2 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.62 1.105 . . . . 0.0 110.525 175.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 64.7 mtm -65.68 -49.03 70.07 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.006 -0.703 . . . . 0.0 109.793 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.2 m -49.62 -44.82 47.64 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.774 1.23 . . . . 0.0 111.86 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -10.55 4.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.977 0.911 . . . . 0.0 113.279 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.78 -45.02 78.24 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 119.515 1.052 . . . . 0.0 108.31 169.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -56.06 -49.51 73.58 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.037 0.446 . . . . 0.0 109.874 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.09 -54.66 34.38 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.305 0.642 . . . . 0.0 110.125 -179.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.4 tp -54.77 -56.04 23.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.513 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 19.2 t80 -52.87 -47.0 68.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.699 1.199 . . . . 0.0 110.782 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -58.38 -41.21 84.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.93 0.332 . . . . 0.0 111.077 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -71.69 -39.23 70.36 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.349 0.595 . . . . 0.0 110.462 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -74.05 -55.44 6.11 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.919 1.688 . . . . 0.0 110.443 -171.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -79.19 40.3 0.41 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.697 1.199 . . . . 0.0 113.814 -167.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.61 67.72 7.69 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.165 -0.96 . . . . 0.0 111.577 -172.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 177.43 -49.91 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 127.469 2.308 . . . . 0.0 108.095 170.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.47 -43.0 20.95 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 177.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 66.13 -46.51 0.42 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 128.04 2.536 . . . . 0.0 114.737 176.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.94 -41.39 7.16 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 118.981 0.809 . . . . 0.0 111.866 173.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -138.07 136.78 37.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.189 0.996 . . . . 0.0 109.813 -176.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.76 117.26 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 126.464 1.905 . . . . 0.0 109.186 -172.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -81.66 156.4 25.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.171 0.988 . . . . 0.0 110.343 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -52.9 -38.28 61.57 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 118.589 0.631 . . . . 0.0 111.005 -175.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -61.02 -39.83 91.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.4 0.68 . . . . 0.0 110.379 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.51 -44.36 62.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -54.55 -39.32 67.59 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 122.882 0.473 . . . . 0.0 111.199 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -58.98 -27.5 65.46 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.168 -0.958 . . . . 0.0 111.469 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -63.31 -44.67 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.318 -0.864 . . . . 0.0 109.203 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 73' ' ' ILE . 16.9 tp -56.3 -47.1 79.34 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 171.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 49.3 t -55.45 -45.6 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 119.765 1.166 . . . . 0.0 111.362 178.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -58.11 -32.03 67.72 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.474 -0.766 . . . . 0.0 111.62 174.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -69.18 -55.67 9.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.753 0.706 . . . . 0.0 111.006 170.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.408 HG23 ' O ' ' A' ' 69' ' ' LEU . 1.0 OUTLIER -54.69 -39.43 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 118.814 0.734 . . . . 0.0 110.605 -173.666 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 69.25 44.91 0.91 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.441 1.096 . . . . 0.0 111.391 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--O 1.251 1.146 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 168.749 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 tptm . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 110.571 -0.159 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.76 -51.38 74.39 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.358 -0.829 . . . . 0.0 112.762 -173.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.59 -46.22 34.78 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.018 1.812 . . . . 0.0 111.915 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.4 mp0 -67.39 -43.17 81.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.575 0.75 . . . . 0.0 110.264 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.19 -52.18 65.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.87 -37.12 83.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.46 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -56.47 -51.85 66.91 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 119.112 0.869 . . . . 0.0 110.649 171.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.44 -55.02 30.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -49.18 -59.77 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.762 0.825 . . . . 0.0 109.39 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -48.2 -57.91 5.26 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.929 1.292 . . . . 0.0 110.392 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -54.6 -46.42 73.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.302 0.641 . . . . 0.0 111.399 179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -59.29 -48.94 79.72 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.927 -0.483 . . . . 0.0 110.951 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 34.3 m-85 -59.05 -56.82 17.32 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.055 0.388 . . . . 0.0 111.216 175.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.21 -53.93 3.88 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.852 1.261 . . . . 0.0 111.365 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.76 -28.12 8.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -59.05 -31.22 68.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.603 1.092 . . . . 0.0 110.853 174.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -83.17 12.71 4.85 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.094 1.758 . . . . 0.0 111.421 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.37 -59.46 3.66 Favored Glycine 0 CA--C 1.529 0.926 0 O-C-N 120.457 -1.402 . . . . 0.0 110.466 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -52.11 113.97 4.87 Favored Pre-proline 0 CA--C 1.534 0.355 0 C-N-CA 123.852 0.861 . . . . 0.0 109.575 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.73 2.5 6.91 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 122.039 1.826 . . . . 0.0 113.322 -172.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -153.17 28.15 0.51 Allowed 'General case' 0 C--N 1.342 0.268 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -172.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -147.62 136.65 22.19 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.605 0.639 . . . . 0.0 110.722 174.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' A' ' 27' ' ' GLU . 52.8 mt -107.11 108.91 20.6 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.996 0.918 . . . . 0.0 110.795 -175.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -64.94 163.57 14.26 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.051 -1.03 . . . . 0.0 109.136 167.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -38.63 -42.71 0.81 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.811 1.644 . . . . 0.0 112.073 174.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.48 -45.83 82.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.305 -0.247 . . . . 0.0 111.59 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.453 ' HB3' HD22 ' A' ' 23' ' ' LEU . 15.6 mp0 -62.72 -48.17 80.38 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.18 -47.65 80.69 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.79 0.836 . . . . 0.0 110.376 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -46.87 86.17 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.545 -0.722 . . . . 0.0 109.546 176.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.8 tp -59.37 -52.94 63.47 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.958 -0.464 . . . . 0.0 110.683 -173.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.402 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.259 1.1 pt? -71.37 -34.12 70.15 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.679 -175.184 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 mp -67.14 -42.25 84.73 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.214 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -58.99 -48.51 81.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.228 0.922 . . . . 0.0 111.265 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 m -63.72 -56.38 16.1 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.066 0.46 . . . . 0.0 110.844 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.42 -34.64 18.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.584 1.154 . . . . 0.0 112.495 -168.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.32 59.62 38.18 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.16 0.984 . . . . 0.0 111.374 -171.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.08 154.63 50.03 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.564 2.176 . . . . 0.0 110.085 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.3 m 69.53 -48.35 0.61 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.702 1.601 . . . . 0.0 112.759 -172.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 mt -57.23 -31.87 65.96 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.291 1.036 . . . . 0.0 112.017 -176.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.5 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.36 -15.04 22.07 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 173.012 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.1 pttt 48.84 49.12 19.56 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.488 1.915 . . . . 0.0 114.243 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.52 143.64 14.94 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.301 0.953 . . . . 0.0 111.38 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.5 ttm -66.7 -55.27 15.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.212 -0.581 . . . . 0.0 110.64 -173.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -48.3 -45.34 34.85 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.234 1.013 . . . . 0.0 111.108 178.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.29 -21.02 1.22 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.557 1.943 . . . . 0.0 113.322 178.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.27 -41.66 50.92 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.71 0.804 . . . . 0.0 110.114 174.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -51.07 70.77 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.22 -54.46 29.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.7 tp -50.3 -55.61 14.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.486 0.715 . . . . 0.0 109.79 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -53.03 -51.46 61.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.109 0.564 . . . . 0.0 110.331 177.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -57.51 -38.57 74.86 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.434 0.561 . . . . 0.0 112.162 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.19 -33.78 72.15 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.237 0.615 . . . . 0.0 110.195 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -80.39 -56.13 4.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.628 1.171 . . . . 0.0 110.824 -173.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.02 40.87 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.462 1.505 . . . . 0.0 114.816 -166.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -50.46 -47.89 56.74 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -170.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.28 -34.32 17.74 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.242 0.617 . . . . 0.0 110.472 173.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.33 -33.94 66.79 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 126.69 2.09 . . . . 0.0 113.709 -174.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.6 t0 32.62 56.83 0.41 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.322 2.249 . . . . 0.0 112.63 172.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 134.32 -45.32 1.12 Allowed Glycine 0 CA--C 1.525 0.679 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.341 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -138.62 134.08 33.28 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.115 0.957 . . . . 0.0 110.579 -175.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.6 t -87.96 119.49 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 124.097 0.959 . . . . 0.0 109.651 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 84.3 p -82.56 158.03 23.27 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.914 0.886 . . . . 0.0 111.132 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -55.61 -37.61 68.37 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.127 0.489 . . . . 0.0 110.801 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -56.59 -47.47 79.5 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.833 1.253 . . . . 0.0 109.973 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.8 -36.98 76.13 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.385 0.612 . . . . 0.0 109.61 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -56.27 -37.52 69.93 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.797 -0.564 . . . . 0.0 110.74 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -55.77 -35.96 66.81 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.645 -1.284 . . . . 0.0 111.896 171.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.56 -48.76 83.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.77 -40.76 30.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.417 0.687 . . . . 0.0 111.583 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.3 t -44.97 -42.98 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.93 175.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -66.52 -26.47 67.16 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 122.05 -0.406 . . . . 0.0 110.969 -175.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -79.26 -58.69 3.09 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 175.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 26.0 pt -54.71 -39.35 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.185 -175.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m 71.83 -55.59 0.66 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.369 1.467 . . . . 0.0 111.486 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 . . . . . 0 C--O 1.25 1.113 0 C-N-CA 125.963 1.705 . . . . 0.0 110.727 169.473 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 tptm . . . . . 0 N--CA 1.475 0.777 0 CA-C-O 120.319 0.104 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.88 -49.41 74.17 Favored Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-O 117.877 -1.059 . . . . 0.0 113.187 -171.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.45 -47.11 25.95 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.043 1.829 . . . . 0.0 112.552 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.7 -46.14 73.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.365 0.666 . . . . 0.0 109.844 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -55.24 -50.98 68.07 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 109.544 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.92 -37.49 86.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.94 0.896 . . . . 0.0 110.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -57.03 -50.31 73.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.863 0.756 . . . . 0.0 110.353 170.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.17 -55.39 28.5 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 178.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.1 mt -50.93 -58.87 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -46.39 -57.68 4.43 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.988 1.315 . . . . 0.0 111.026 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.39 -37.88 88.3 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.267 0.485 . . . . 0.0 111.071 -175.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -61.79 -43.79 98.15 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.74 -0.6 . . . . 0.0 111.022 177.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -60.02 -58.25 9.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.018 -0.426 . . . . 0.0 111.199 171.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.467 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.07 -53.53 4.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.214 1.006 . . . . 0.0 111.492 178.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.56 -32.39 5.36 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -59.96 -31.24 69.69 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.339 0.972 . . . . 0.0 110.846 177.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -84.47 12.7 6.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.062 1.745 . . . . 0.0 111.399 175.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.8 -60.16 3.77 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 120.491 -1.381 . . . . 0.0 110.618 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -52.87 112.21 3.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.856 0.862 . . . . 0.0 108.984 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.22 -5.25 16.69 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.05 1.833 . . . . 0.0 113.01 -171.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -142.33 27.83 1.71 Allowed 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.087 0.858 . . . . 0.0 113.155 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.467 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 0.1 OUTLIER -154.31 140.71 18.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.026 0.83 . . . . 0.0 112.445 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.1 mt -114.62 112.54 23.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.527 1.131 . . . . 0.0 111.58 -175.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.1 p -62.05 165.08 5.93 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.989 -1.069 . . . . 0.0 110.112 168.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -40.67 -46.74 2.66 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 123.915 0.886 . . . . 0.0 111.705 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.61 -52.44 65.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.496 0.318 . . . . 0.0 110.242 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -65.87 -39.75 90.99 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.035 0.445 . . . . 0.0 110.082 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.26 -49.14 78.29 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.81 1.644 . . . . 0.0 109.261 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -58.82 -46.85 86.69 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.386 -0.821 . . . . 0.0 110.315 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.8 tp -52.54 -58.64 6.12 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.41 -0.806 . . . . 0.0 111.824 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.279 1.2 pt? -69.97 -34.74 73.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 119.246 -0.982 . . . . 0.0 112.099 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.3 -42.06 99.0 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 119.535 1.062 . . . . 0.0 110.542 175.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -57.21 -52.91 63.43 Favored 'General case' 0 CA--C 1.527 0.064 0 CA-C-N 119.232 0.924 . . . . 0.0 110.924 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.9 m -62.32 -52.22 64.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.722 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -89.11 -34.96 16.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.07 0.948 . . . . 0.0 112.89 -168.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -124.59 81.23 60.48 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -168.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -45.56 150.92 1.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.597 3.531 . . . . 0.0 113.156 169.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 t 69.85 -56.38 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.118 1.767 . . . . 0.0 111.919 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -53.56 -35.61 60.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.229 1.012 . . . . 0.0 111.49 -174.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.425 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.94 -13.53 2.76 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 176.683 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.405 ' N ' HD22 ' A' ' 40' ' ' LEU . 33.9 ttpt -76.98 45.61 0.44 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.205 1.366 . . . . 0.0 112.668 -169.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.52 59.66 4.07 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 174.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 92.1 mtp -59.21 103.13 0.16 Allowed 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.1 m 68.64 -54.21 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.841 2.056 . . . . 0.0 110.978 -169.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.5 p -43.83 -18.37 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.836 2.855 . . . . 0.0 115.135 173.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.69 -41.65 32.34 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 120.539 1.518 . . . . 0.0 108.681 168.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -54.16 -51.94 62.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 122.17 0.188 . . . . 0.0 110.955 177.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -64.05 -53.56 47.93 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.328 0.651 . . . . 0.0 110.097 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.9 tp -50.05 -57.44 7.6 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.602 0.761 . . . . 0.0 109.119 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -54.1 -46.26 72.06 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.856 0.863 . . . . 0.0 111.403 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.92 -44.48 86.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.808 0.731 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -72.45 -46.01 56.92 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.868 0.366 . . . . 0.0 110.179 -176.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.06 -59.56 4.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.379 1.472 . . . . 0.0 109.048 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -80.37 47.53 0.93 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.93 1.692 . . . . 0.0 110.556 -173.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ttmm -57.07 -34.42 68.26 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -167.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.39 -50.34 5.86 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.079 0.552 . . . . 0.0 110.869 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.19 -39.44 52.62 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.278 -171.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.9 t0 36.39 54.12 1.03 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.368 1.867 . . . . 0.0 112.469 -174.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.68 -57.6 0.08 OUTLIER Glycine 0 CA--C 1.525 0.683 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 -175.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -132.39 137.94 47.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.455 1.102 . . . . 0.0 108.582 172.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.1 t -88.22 114.7 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 126.02 1.728 . . . . 0.0 108.569 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.7 p -76.47 159.57 30.29 Favored 'General case' 0 C--N 1.335 -0.047 0 C-N-CA 123.741 0.816 . . . . 0.0 110.53 172.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -55.33 -34.79 64.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.499 0.666 . . . . 0.0 111.174 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.88 -49.44 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.093 0.957 . . . . 0.0 110.393 174.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.65 -40.27 69.8 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -55.22 -41.85 72.58 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 121.796 -0.565 . . . . 0.0 110.601 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -57.59 -31.72 66.47 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.482 -0.761 . . . . 0.0 112.365 176.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.58 -28.84 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.558 -0.714 . . . . 0.0 110.932 171.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -74.08 -45.46 49.1 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.202 -0.936 . . . . 0.0 108.608 169.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 90.9 t -54.34 -45.77 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.267 -0.896 . . . . 0.0 111.76 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -59.33 -21.55 59.94 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.335 -0.853 . . . . 0.0 111.913 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -78.67 -54.0 6.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.513 0.597 . . . . 0.0 109.577 169.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.41 -35.13 36.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 118.521 0.6 . . . . 0.0 111.559 -176.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 m 75.13 -37.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.013 1.725 . . . . 0.0 113.278 173.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 . . . . . 0 C--O 1.252 1.185 0 CA-C-O 117.223 -1.37 . . . . 0.0 111.834 176.03 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.32 -50.66 55.7 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.85 -176.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.82 -44.37 31.95 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.266 1.977 . . . . 0.0 112.711 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -71.67 -42.25 67.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.896 0.478 . . . . 0.0 110.312 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.29 -52.08 65.84 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.142 0.496 . . . . 0.0 109.86 174.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.4 mt -64.14 -37.9 89.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.522 0.729 . . . . 0.0 109.826 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -55.88 -52.59 63.56 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 118.292 0.497 . . . . 0.0 110.047 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.01 -55.68 20.12 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.25 -54.75 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -46.25 -54.81 8.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.793 1.237 . . . . 0.0 109.626 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.59 -44.93 93.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.467 0.707 . . . . 0.0 110.824 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -61.25 -45.22 95.42 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 117.957 0.344 . . . . 0.0 111.375 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 30.5 m-85 -60.79 -60.51 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.013 -0.429 . . . . 0.0 111.084 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.35 -49.78 6.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.037 1.735 . . . . 0.0 112.758 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.36 -32.28 11.03 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.956 0.903 . . . . 0.0 113.396 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -62.8 -30.99 71.89 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.243 -0.911 . . . . 0.0 110.797 176.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.54 24.21 1.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.688 1.195 . . . . 0.0 110.753 170.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.75 -66.36 2.76 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 121.273 -0.892 . . . . 0.0 111.175 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -67.63 114.01 17.39 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.154 0.582 . . . . 0.0 109.822 -175.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -64.89 -22.23 63.34 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.167 1.911 . . . . 0.0 111.942 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -105.86 35.57 2.85 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.362 0.665 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -160.09 132.48 6.39 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.671 1.123 . . . . 0.0 113.93 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.86 152.76 23.47 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 125.889 1.676 . . . . 0.0 107.047 172.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.8 p -94.45 174.07 7.31 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.503 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -53.21 -38.93 63.32 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 119.649 1.113 . . . . 0.0 112.337 167.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.7 -51.88 63.07 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -62.64 -40.42 96.95 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.267 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.84 -49.86 75.79 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.132 0.573 . . . . 0.0 109.476 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -53.89 -51.04 64.98 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.621 -0.674 . . . . 0.0 109.978 175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -51.16 -62.23 1.74 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.416 0.686 . . . . 0.0 111.676 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.408 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.269 1.0 OUTLIER -70.79 -30.64 67.16 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.876 -176.156 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.28 -42.99 96.15 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 120.398 1.453 . . . . 0.0 109.63 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -58.32 -50.54 73.25 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.856 0.753 . . . . 0.0 110.838 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 m -61.15 -56.03 25.48 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.044 0.449 . . . . 0.0 110.719 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -87.13 -40.7 14.39 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.089 1.356 . . . . 0.0 112.078 -169.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -120.68 57.05 5.42 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 123.872 0.869 . . . . 0.0 111.033 -170.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -58.96 155.31 39.44 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.189 1.926 . . . . 0.0 109.941 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.9 m 70.08 -42.9 0.53 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.172 1.389 . . . . 0.0 113.283 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.5 mt -60.08 -37.58 80.34 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.721 1.146 . . . . 0.0 111.098 -176.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.463 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -63.58 -16.88 62.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 173.868 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? 67.4 -64.38 0.26 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.855 2.062 . . . . 0.0 111.671 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.67 176.83 44.05 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -52.02 66.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.963 0.381 . . . . 0.0 111.857 -177.217 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.3 m -52.14 -48.87 64.65 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.393 0.677 . . . . 0.0 111.559 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -18.95 32.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.666 1.187 . . . . 0.0 112.944 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.2 tp -52.71 -40.09 62.67 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 119.433 1.015 . . . . 0.0 109.227 170.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.75 -53.01 60.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.672 0.669 . . . . 0.0 110.495 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -62.5 -58.25 8.28 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.8 mp -53.36 -52.7 58.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 7.6 t80 -57.43 -45.85 84.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.703 0.401 . . . . 0.0 110.641 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -58.28 -41.68 84.9 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.062 0.392 . . . . 0.0 111.336 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -69.89 -44.12 70.4 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.526 0.679 . . . . 0.0 109.768 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.55 -52.22 23.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.272 1.429 . . . . 0.0 110.851 -172.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -75.87 74.4 2.8 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.063 0.945 . . . . 0.0 109.691 -172.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -53.52 -33.68 55.38 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.34 1.056 . . . . 0.0 111.788 174.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.98 -22.68 66.48 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 176.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 54.28 41.05 69.86 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 124.817 1.198 . . . . 0.0 112.201 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -110.54 4.32 20.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.699 1.2 . . . . 0.0 112.109 -177.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.58 85.13 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 118.308 0.504 . . . . 0.0 111.918 -177.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -134.3 168.89 18.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.026 1.33 . . . . 0.0 109.285 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 67.5 t -139.55 109.39 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.05 1.34 . . . . 0.0 107.52 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.7 m -80.71 161.02 24.78 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 122.825 0.45 . . . . 0.0 111.098 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -51.55 -38.97 56.84 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-O 121.423 0.63 . . . . 0.0 110.753 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.09 -38.3 90.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.057 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.27 -45.35 63.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.4 -40.51 62.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.894 0.478 . . . . 0.0 110.966 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -55.52 -30.78 61.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.983 0.513 . . . . 0.0 111.882 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.4 t -61.7 -41.01 88.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 121.371 -0.831 . . . . 0.0 109.645 172.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -48.46 81.61 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 172.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 68.0 t -53.01 -43.82 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 O-C-N 121.724 -0.61 . . . . 0.0 111.485 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -55.52 -30.77 61.29 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.641 -0.662 . . . . 0.0 111.935 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -76.66 -52.03 10.41 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.516 0.598 . . . . 0.0 110.427 172.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.64 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 119.046 0.839 . . . . 0.0 111.609 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 m 73.58 -64.32 0.4 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.078 2.151 . . . . 0.0 112.576 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.107 -0.949 . . . . 0.0 112.073 -176.272 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 54.6 tttt . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.515 0.197 . . . . 0.0 111.351 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -47.84 -49.59 57.13 Favored Pre-proline 0 N--CA 1.45 -0.453 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -169.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.47 -54.3 5.29 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.03 1.82 . . . . 0.0 112.604 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -74.26 -35.96 63.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.387 0.275 . . . . 0.0 111.71 -177.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.97 -56.56 20.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.558 0.694 . . . . 0.0 109.303 176.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.64 -31.31 70.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.298 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.79 -50.24 71.01 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.706 1.139 . . . . 0.0 110.381 169.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.39 -55.41 22.35 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.599 -1.0 . . . . 0.0 110.599 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.403 HD13 HG21 ' A' ' 9' ' ' ILE . 48.5 mt -54.43 -59.12 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -42.32 -54.71 3.65 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.784 1.234 . . . . 0.0 110.539 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.53 -45.04 92.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.707 0.803 . . . . 0.0 110.062 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -59.9 -45.47 92.45 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 122.32 -0.238 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.1 m-85 -61.02 -58.85 6.7 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.15 0.432 . . . . 0.0 111.329 173.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -46.84 7.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.398 1.479 . . . . 0.0 112.748 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.33 -30.81 8.1 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.668 1.187 . . . . 0.0 113.681 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -73.28 -27.89 61.81 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.42 0.555 . . . . 0.0 111.14 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -72.3 151.31 42.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.295 1.438 . . . . 0.0 109.451 -178.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -45.83 -45.86 13.73 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 124.129 0.871 . . . . 0.0 112.238 172.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -88.58 105.3 9.3 Favored Pre-proline 0 CA--C 1.533 0.327 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 169.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -66.56 -9.17 23.26 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.361 2.041 . . . . 0.0 113.648 -169.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -118.0 28.14 8.57 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.055 0.843 . . . . 0.0 110.741 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -149.37 156.4 41.99 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.147 0.43 . . . . 0.0 112.018 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.2 mt -110.24 110.32 21.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.917 0.887 . . . . 0.0 109.202 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.6 p -69.33 163.54 24.89 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 169.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 99.3 mttt -39.16 -46.09 1.41 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.202 1.001 . . . . 0.0 113.343 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -74.38 -32.63 62.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.191 0.451 . . . . 0.0 112.077 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -69.23 -45.58 69.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.93 -46.22 82.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.264 1.425 . . . . 0.0 109.434 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -57.38 -53.3 59.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 121.585 -0.697 . . . . 0.0 109.75 173.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -54.28 -53.37 54.61 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.878 0.471 . . . . 0.0 111.171 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.285 1.2 pt? -70.89 -35.17 72.21 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 118.903 -1.119 . . . . 0.0 112.081 -176.556 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.63 -36.59 84.13 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 119.591 1.087 . . . . 0.0 110.185 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -51.85 67.28 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.765 0.711 . . . . 0.0 109.808 173.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -63.75 -56.23 17.15 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 110.032 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -83.56 -36.99 23.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.239 1.016 . . . . 0.0 111.842 -169.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -130.01 56.51 24.94 Favored Pre-proline 0 CA--C 1.541 0.599 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -169.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.75 72.38 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 124.458 3.439 . . . . 0.0 111.24 -177.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.0 m -177.05 -39.15 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 127.91 2.484 . . . . 0.0 109.161 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.66 -46.38 84.32 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 110.231 -172.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.567 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -73.36 71.82 1.28 Allowed 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.533 0.733 . . . . 0.0 109.315 172.221 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.19 76.68 0.09 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.634 1.173 . . . . 0.0 110.089 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.65 102.63 1.64 Allowed Glycine 0 CA--C 1.523 0.586 0 N-CA-C 106.931 -2.468 . . . . 0.0 106.931 -169.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 57.5 ttm -31.79 -48.99 0.16 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.158 2.183 . . . . 0.0 114.648 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 m -40.98 -37.91 0.89 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.03 1.732 . . . . 0.0 113.709 176.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.7 p -54.97 -16.98 3.15 Favored 'General case' 0 C--N 1.338 0.103 0 CA-C-O 118.022 -0.989 . . . . 0.0 113.477 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.9 tp -46.42 -41.32 13.58 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.632 1.105 . . . . 0.0 109.749 169.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -54.01 -55.75 24.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.205 0.202 . . . . 0.0 110.861 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.63 -47.99 68.03 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -173.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 77.3 mt -50.91 -61.95 1.9 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 12.7 t80 -55.22 -44.37 75.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.323 0.51 . . . . 0.0 111.267 -178.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -56.64 -43.8 80.67 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.348 0.259 . . . . 0.0 111.085 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -72.21 -43.37 64.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.465 0.65 . . . . 0.0 109.863 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.73 -51.53 54.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.985 1.714 . . . . 0.0 110.562 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -77.3 71.87 3.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 109.673 -172.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -46.43 -43.12 16.21 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.573 1.549 . . . . 0.0 111.956 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.06 -19.47 63.28 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.431 0.692 . . . . 0.0 112.424 -178.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.52 83.08 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.667 -0.973 . . . . 0.0 110.667 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -76.17 -12.58 60.12 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.531 -0.393 . . . . 0.0 111.501 -177.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.44 6.78 88.85 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -169.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -147.95 160.67 42.57 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.47 1.908 . . . . 0.0 107.315 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 42.4 t -116.43 115.39 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 125.54 1.536 . . . . 0.0 108.098 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.8 p -73.6 166.61 22.95 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.392 1.077 . . . . 0.0 110.622 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -53.2 -43.65 67.35 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.115 0.483 . . . . 0.0 110.156 171.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -64.16 -46.82 82.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 122.932 0.493 . . . . 0.0 109.724 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.94 -47.01 88.39 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.25 0.548 . . . . 0.0 109.652 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -54.1 -39.89 66.8 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.857 0.863 . . . . 0.0 111.181 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -56.2 -27.34 54.28 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.422 -0.799 . . . . 0.0 111.902 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.85 -46.86 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 119.102 0.865 . . . . 0.0 109.189 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -40.53 69.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.417 0.687 . . . . 0.0 109.856 174.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.4 t -54.7 -28.29 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.378 -0.826 . . . . 0.0 112.173 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -67.52 -38.59 84.47 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 120.002 -1.686 . . . . 0.0 110.435 173.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.32 -43.08 78.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.963 0.505 . . . . 0.0 110.366 178.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.8 -37.29 79.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.773 174.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.3 m 74.09 -42.88 0.52 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.838 2.055 . . . . 0.0 112.639 177.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.551 1.14 . . . . 0.0 111.254 173.666 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.8 pttt . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -46.44 -54.6 17.56 Favored Pre-proline 0 N--CA 1.453 -0.298 0 CA-C-O 117.665 -1.159 . . . . 0.0 111.564 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -40.58 -45.57 4.57 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.032 2.488 . . . . 0.0 114.622 170.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -72.4 -42.5 65.08 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.886 0.766 . . . . 0.0 110.297 -176.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -57.08 -51.73 68.11 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.71 -41.28 90.46 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.088 0.955 . . . . 0.0 110.268 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.72 -51.36 69.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.334 0.516 . . . . 0.0 110.046 173.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.54 -56.75 18.45 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 177.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.89 -58.63 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 123.952 0.901 . . . . 0.0 109.289 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -47.57 -55.55 9.0 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.479 1.512 . . . . 0.0 110.402 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.65 -45.71 88.73 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.132 0.573 . . . . 0.0 111.618 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -58.92 -49.17 78.83 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.131 -0.355 . . . . 0.0 110.827 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 24.7 m-85 -58.29 -56.45 21.97 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.013 -0.43 . . . . 0.0 111.197 174.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.506 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -44.02 -51.68 7.63 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.704 1.202 . . . . 0.0 112.48 177.297 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.05 -30.97 6.92 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 177.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -60.67 -33.1 72.32 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.32 -0.862 . . . . 0.0 111.302 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.3 31.36 1.73 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.493 0.588 . . . . 0.0 111.021 171.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.33 -68.26 2.69 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 174.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -54.48 105.85 0.58 Allowed Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.847 1.259 . . . . 0.0 109.85 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -80.4 32.67 0.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.687 2.258 . . . . 0.0 112.329 -169.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.57 25.51 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.395 -0.816 . . . . 0.0 112.9 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.506 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 3.4 tt0 -150.96 142.05 23.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.963 0.505 . . . . 0.0 110.8 -175.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.6 mt -120.39 129.9 54.13 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.83 1.252 . . . . 0.0 107.911 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 t -93.55 168.07 11.27 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 167.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -48.14 -34.62 10.18 Favored 'General case' 0 N--CA 1.461 0.125 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -170.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -70.5 -40.63 73.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.959 -0.463 . . . . 0.0 110.742 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.4 -42.42 75.12 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.51 -48.56 80.44 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 122.435 0.294 . . . . 0.0 110.987 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -62.69 -42.43 99.63 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 118.031 -1.468 . . . . 0.0 109.207 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.1 tp -54.49 -59.17 5.05 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.99 -0.444 . . . . 0.0 111.192 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.254 1.3 pt? -70.28 -35.33 73.65 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 119.032 -1.067 . . . . 0.0 112.245 -174.9 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -42.51 98.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 119.414 1.006 . . . . 0.0 110.119 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.22 -48.48 81.55 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.275 0.943 . . . . 0.0 111.11 173.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -61.19 -55.95 26.28 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.043 0.449 . . . . 0.0 110.562 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -87.1 -38.68 16.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.451 1.1 . . . . 0.0 112.069 -169.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.75 58.88 30.83 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 124.118 0.967 . . . . 0.0 111.758 -170.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -58.88 158.76 23.52 Favored 'Trans proline' 0 N--CA 1.449 -1.125 0 C-N-CA 122.278 1.985 . . . . 0.0 110.076 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.6 m 70.44 -41.21 0.49 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.15 1.38 . . . . 0.0 113.466 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.89 -39.06 84.06 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.849 1.204 . . . . 0.0 111.082 -176.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.497 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -66.58 -9.73 38.25 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 174.005 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.9 tttt 65.22 -69.15 0.1 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.965 2.106 . . . . 0.0 112.336 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 170.74 137.47 2.3 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.646 -0.582 . . . . 0.0 111.646 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.5 mpp? 24.07 -97.33 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 129.013 2.925 . . . . 0.0 113.362 170.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.6 m -45.12 -40.78 7.26 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.994 1.718 . . . . 0.0 112.977 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.61 -29.92 53.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.357 0.663 . . . . 0.0 111.457 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.0 tp -52.68 -40.49 62.97 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.203 0.601 . . . . 0.0 110.135 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.74 -51.91 67.05 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.28 0.491 . . . . 0.0 110.014 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -66.9 -49.48 65.45 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.777 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.1 tp -54.51 -53.28 56.46 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -54.92 -47.89 73.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.486 0.714 . . . . 0.0 110.624 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -58.4 -40.44 82.42 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.168 0.44 . . . . 0.0 111.305 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.23 -47.8 63.73 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 121.668 0.747 . . . . 0.0 109.33 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -64.57 -57.45 9.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.609 1.563 . . . . 0.0 110.537 -174.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -74.34 75.18 1.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -51.01 -37.09 42.98 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.651 1.18 . . . . 0.0 111.504 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.51 -23.67 66.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.616 0.766 . . . . 0.0 112.662 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.13 37.45 91.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.197 0.903 . . . . 0.0 112.017 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -98.83 0.03 43.45 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.034 0.934 . . . . 0.0 112.392 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.4 16.6 70.91 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 -177.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -142.22 160.76 39.6 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.182 0.993 . . . . 0.0 110.102 -176.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.46 103.95 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 76.5 p -68.15 173.6 4.56 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.355 0.662 . . . . 0.0 109.454 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -58.36 -35.87 72.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.737 0.78 . . . . 0.0 110.343 171.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -62.54 -51.69 66.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.857 0.863 . . . . 0.0 109.727 178.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.95 -46.29 88.38 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.02 -41.5 71.4 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.51 -0.744 . . . . 0.0 111.559 -177.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -56.54 -27.81 58.53 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.455 -0.778 . . . . 0.0 112.584 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.53 -35.98 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 119.432 1.015 . . . . 0.0 110.484 170.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.88 -48.76 73.1 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 171.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 63.8 t -54.08 -42.76 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 122.112 -0.368 . . . . 0.0 111.03 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -51.45 -34.29 34.57 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.07 -0.394 . . . . 0.0 111.397 175.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -82.64 -46.01 13.81 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.161 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.91 -34.04 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.863 1.211 . . . . 0.0 110.978 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.4 m 82.37 -50.06 0.2 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 127.036 2.135 . . . . 0.0 112.486 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 117.239 -1.363 . . . . 0.0 110.643 -177.565 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.2 -49.1 63.11 Favored Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 124.402 1.081 . . . . 0.0 113.302 -172.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.72 -46.68 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.098 1.866 . . . . 0.0 112.109 175.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -68.85 -41.96 77.77 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.307 0.643 . . . . 0.0 110.064 -177.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.22 -52.11 65.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.03 -34.08 76.93 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 119.405 -0.331 . . . . 0.0 110.405 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -59.14 -51.06 71.66 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.708 0.685 . . . . 0.0 110.57 169.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.75 -54.19 34.72 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.4 mt -44.61 -64.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 125.084 1.354 . . . . 0.0 109.651 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -45.25 -53.96 7.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.74 0.816 . . . . 0.0 110.443 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.16 -49.95 74.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.934 0.894 . . . . 0.0 111.863 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.16 -45.57 92.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.529 1.058 . . . . 0.0 110.944 -179.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -58.74 -53.55 57.11 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.88 -0.513 . . . . 0.0 110.759 177.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -53.93 19.32 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.889 1.276 . . . . 0.0 111.463 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.08 -39.39 59.64 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.406 -0.808 . . . . 0.0 112.105 172.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -69.63 -36.71 76.36 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.799 0.727 . . . . 0.0 110.967 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -48.59 80.48 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.25 -57.06 0.51 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.31 108.77 3.11 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -59.57 -26.69 82.87 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.389 2.059 . . . . 0.0 111.5 -175.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -95.6 5.82 50.5 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 116.761 -1.59 . . . . 0.0 112.774 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -151.97 141.85 22.03 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -168.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.1 mt -106.65 127.76 53.62 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 125.62 1.568 . . . . 0.0 109.535 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.2 p -71.92 171.4 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.287 -0.883 . . . . 0.0 109.044 168.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 8.4 mtmp? -45.86 -44.61 14.49 Favored 'General case' 0 C--O 1.226 -0.173 0 O-C-N 121.637 -0.664 . . . . 0.0 110.969 167.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mp0 -68.39 -47.69 66.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.746 0.418 . . . . 0.0 109.936 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -61.62 -41.74 97.9 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.48 -48.77 80.38 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.702 1.201 . . . . 0.0 109.851 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -59.87 -48.9 79.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.228 -0.92 . . . . 0.0 110.093 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.4 tp -50.98 -60.86 2.64 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.88 0.872 . . . . 0.0 111.244 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 1.1 pt? -69.18 -31.67 70.45 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 119.063 -1.055 . . . . 0.0 112.199 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -65.92 -43.55 87.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 119.994 1.27 . . . . 0.0 110.55 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -55.84 -54.02 49.59 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.013 0.824 . . . . 0.0 110.677 171.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.0 m -65.67 -52.71 49.52 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.564 0.221 . . . . 0.0 111.289 -169.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -80.56 -39.05 28.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.634 0.773 . . . . 0.0 111.346 -175.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -126.88 62.58 51.88 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.364 -169.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.47 75.17 0.38 Allowed 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 124.711 3.607 . . . . 0.0 112.215 -173.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.2 m 176.19 -42.2 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 129.381 3.073 . . . . 0.0 108.414 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -81.72 51.96 1.81 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.77 0.828 . . . . 0.0 110.535 -172.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -166.47 18.13 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.103 1.361 . . . . 0.0 112.025 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -75.31 70.4 2.22 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.481 0.713 . . . . 0.0 110.514 -173.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 167.58 84.9 0.06 OUTLIER Glycine 0 CA--C 1.524 0.642 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 66.8 mtm -58.71 -59.77 4.88 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 122.412 -0.463 . . . . 0.0 110.7 -173.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.6 p -52.94 -47.14 68.29 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.852 0.861 . . . . 0.0 109.919 173.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -18.85 3.03 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.431 1.492 . . . . 0.0 113.027 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp -50.89 -40.55 56.93 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 119.651 1.114 . . . . 0.0 109.677 171.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -52.84 -57.2 11.0 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.087 0.47 . . . . 0.0 109.92 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.49 -52.26 64.19 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.336 0.655 . . . . 0.0 110.114 -175.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.18 -54.5 35.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.755 0.822 . . . . 0.0 109.141 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.468 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 38.5 t80 -57.79 -45.3 86.23 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.038 0.535 . . . . 0.0 111.337 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.91 -42.94 95.01 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.144 0.884 . . . . 0.0 111.105 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.19 -50.52 67.77 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.807 0.813 . . . . 0.0 109.266 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -60.08 4.4 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 126.328 1.851 . . . . 0.0 109.715 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -80.35 49.82 1.19 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.908 1.683 . . . . 0.0 112.407 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.86 -65.91 0.56 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.315 0.579 . . . . 0.0 109.797 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -83.79 68.29 9.86 Favored 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 121.699 -0.625 . . . . 0.0 109.647 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 174.67 -38.01 0.11 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.858 -0.412 . . . . 0.0 112.301 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.7 t70 67.84 -60.44 0.4 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.224 2.21 . . . . 0.0 113.834 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.77 -28.67 8.18 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.618 1.104 . . . . 0.0 112.699 -174.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -143.64 131.68 21.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.985 0.914 . . . . 0.0 110.411 -177.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 37.9 t -87.43 113.77 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 C-N-CA 127.303 2.241 . . . . 0.0 108.349 -171.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 96.7 p -79.72 165.68 22.57 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.095 0.558 . . . . 0.0 110.359 173.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -55.42 -33.94 63.98 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.917 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.96 -54.82 29.36 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.413 0.685 . . . . 0.0 110.226 173.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -69.11 -38.63 79.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -58.44 -39.51 80.03 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 121.763 -0.586 . . . . 0.0 110.778 179.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -57.62 -35.17 70.12 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.464 1.484 . . . . 0.0 111.967 174.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.98 -39.57 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 121.205 -0.935 . . . . 0.0 109.3 171.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.39 -43.85 88.69 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 169.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.7 t -58.79 -35.35 55.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 119.587 1.085 . . . . 0.0 110.731 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -61.28 -59.35 5.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -55.73 -44.97 78.03 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -173.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 20.4 pt -55.97 -23.48 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.112 0.869 . . . . 0.0 111.885 177.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.2 m 75.59 -53.37 0.64 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 126.026 1.731 . . . . 0.0 112.635 170.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.089 0 C-N-CA 125.561 1.545 . . . . 0.0 112.604 -173.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.3 tttm . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 110.537 -0.172 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.25 -51.37 42.64 Favored Pre-proline 0 N--CA 1.453 -0.323 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.456 -169.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.62 -40.79 30.68 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.54 2.16 . . . . 0.0 113.294 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -71.1 -46.19 62.22 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.115 0.566 . . . . 0.0 109.994 -176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -58.37 -50.78 72.42 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.38 -40.81 95.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.997 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -56.96 -50.88 71.29 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 118.556 0.616 . . . . 0.0 110.527 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.67 -54.47 32.78 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 9' ' ' ILE . 57.1 mt -50.01 -64.36 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 123.93 0.892 . . . . 0.0 109.352 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -45.73 -52.19 11.39 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.18 1.392 . . . . 0.0 110.239 -178.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.82 -45.96 91.56 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.626 1.171 . . . . 0.0 110.457 -175.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.29 -49.04 79.19 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.252 -0.28 . . . . 0.0 110.557 178.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -56.28 -60.54 3.36 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 117.972 0.351 . . . . 0.0 111.388 175.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.28 -55.12 3.46 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.923 1.689 . . . . 0.0 111.914 177.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.14 -26.57 6.87 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -58.89 -31.84 68.96 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.68 1.127 . . . . 0.0 110.564 175.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -91.79 25.64 2.67 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.584 1.153 . . . . 0.0 110.973 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.72 -64.55 2.97 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.24 113.56 7.75 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.597 0.759 . . . . 0.0 109.709 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.5 -20.14 21.01 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.189 1.926 . . . . 0.0 112.138 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -103.09 16.46 26.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 117.982 -1.009 . . . . 0.0 112.643 -171.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -154.9 141.79 19.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -168.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.4 mt -119.99 135.19 55.01 Favored 'General case' 0 C--N 1.345 0.402 0 C-N-CA 125.658 1.583 . . . . 0.0 109.575 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.9 p -74.13 172.67 11.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.105 0.866 . . . . 0.0 109.181 168.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -55.33 -38.42 68.71 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.041 -1.037 . . . . 0.0 112.152 168.306 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.31 -52.41 64.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.84 -40.78 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.55 -47.31 86.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.368 1.067 . . . . 0.0 110.027 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -57.24 -51.44 69.36 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.664 -0.815 . . . . 0.0 109.536 172.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.1 tp -52.6 -55.86 19.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.629 0.372 . . . . 0.0 111.773 -173.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.26 1.3 pt? -69.85 -35.55 74.82 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 119.143 -1.023 . . . . 0.0 112.249 -177.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -64.77 -40.4 95.2 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 120.562 1.528 . . . . 0.0 109.936 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.5 tm0? -56.34 -52.18 65.53 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.007 0.523 . . . . 0.0 111.003 171.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.55 -49.6 58.24 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 -172.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -86.47 -37.5 18.21 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.173 0.989 . . . . 0.0 111.589 -169.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -126.47 62.04 46.15 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.22 1.008 . . . . 0.0 111.649 -175.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.15 73.76 0.49 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.853 3.702 . . . . 0.0 112.016 -174.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 m 176.92 -36.64 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 128.624 2.77 . . . . 0.0 109.675 -176.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -67.13 -43.94 81.1 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.839 -0.538 . . . . 0.0 110.679 -169.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.568 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.59 49.85 0.05 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.452 2.301 . . . . 0.0 113.916 177.444 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.41 75.12 0.38 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.777 1.231 . . . . 0.0 113.36 -170.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.61 137.95 7.11 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.502 1.525 . . . . 0.0 110.332 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -60.94 -51.36 69.62 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.378 -0.484 . . . . 0.0 110.318 -179.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 m -51.94 -46.49 64.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.924 0.89 . . . . 0.0 110.425 177.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.13 -25.59 13.81 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.23 1.412 . . . . 0.0 112.519 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp -55.26 -40.67 71.25 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.887 0.767 . . . . 0.0 110.008 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.48 -55.39 32.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -60.82 -53.74 53.71 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.069 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.48 -54.57 39.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.793 0.837 . . . . 0.0 109.183 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' A' ' 61' ' ' VAL . 41.2 t80 -57.51 -45.42 84.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.515 0.726 . . . . 0.0 111.196 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -61.18 -45.03 96.29 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 118.799 0.727 . . . . 0.0 110.89 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.13 -47.07 84.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.559 0.695 . . . . 0.0 109.346 -176.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -61.2 2.52 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.887 1.675 . . . . 0.0 109.77 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -80.58 54.99 2.2 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.476 1.51 . . . . 0.0 111.75 -168.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -53.58 -48.44 69.19 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 123.214 0.605 . . . . 0.0 111.396 -174.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.41 -48.62 26.62 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.695 0.398 . . . . 0.0 111.687 -176.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -82.07 -39.82 11.09 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.739 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.4 t0 38.19 52.79 1.65 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.713 1.605 . . . . 0.0 112.028 -170.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 174.61 -50.07 0.14 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 -172.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -138.76 128.93 25.52 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.561 1.144 . . . . 0.0 109.691 179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.52 HG23 ' CE1' ' A' ' 50' ' ' PHE . 66.3 t -87.37 99.8 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 -178.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.3 m -68.53 155.52 39.79 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -46.5 -36.99 7.25 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.542 0.686 . . . . 0.0 112.178 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -60.62 -41.19 94.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.718 0.807 . . . . 0.0 110.927 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -72.34 -40.84 67.09 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 174.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.4 -42.63 64.19 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.708 -0.62 . . . . 0.0 110.961 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -39.74 20.09 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.667 -0.645 . . . . 0.0 112.494 172.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.1 t -61.42 -39.84 84.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 O-C-N 121.746 -0.596 . . . . 0.0 110.149 175.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.44 -51.63 69.07 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t -53.54 -41.71 46.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 117.929 0.331 . . . . 0.0 111.057 -176.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -51.68 -37.11 49.19 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.049 0.539 . . . . 0.0 111.502 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -78.46 -50.93 10.78 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.081 0.552 . . . . 0.0 110.62 174.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.55 -32.04 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 118.831 0.741 . . . . 0.0 111.724 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.2 m 75.54 -44.27 0.52 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.944 2.098 . . . . 0.0 113.255 171.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 125.997 1.719 . . . . 0.0 111.93 179.067 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.65 -53.7 51.09 Favored Pre-proline 0 N--CA 1.45 -0.45 0 CA-C-O 117.695 -1.145 . . . . 0.0 112.403 -174.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -50.75 11.14 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.367 2.045 . . . . 0.0 112.315 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.64 -48.04 82.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.192 0.597 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.04 -50.17 71.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.764 0.426 . . . . 0.0 109.852 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.65 -38.7 92.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.108 0.963 . . . . 0.0 109.593 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -59.56 -52.37 65.83 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.271 0.487 . . . . 0.0 110.387 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.51 -54.22 36.06 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.8 mt -45.19 -64.32 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.558 1.143 . . . . 0.0 109.497 172.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -48.21 -56.13 8.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.463 1.505 . . . . 0.0 110.534 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -56.91 -47.02 81.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.56 0.344 . . . . 0.0 110.889 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -60.51 -44.17 96.29 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.984 -0.448 . . . . 0.0 111.113 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -59.66 -57.28 13.62 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 118.161 0.437 . . . . 0.0 111.132 174.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -50.52 13.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.776 0.83 . . . . 0.0 111.633 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.7 -25.89 20.48 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -61.8 -36.54 81.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.445 1.021 . . . . 0.0 110.869 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -73.85 -50.53 19.92 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 149.44 -46.58 0.65 Allowed Glycine 0 C--N 1.334 0.462 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -53.93 121.33 28.63 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.52 -11.26 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.744 1.63 . . . . 0.0 112.772 -174.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.33 37.51 0.69 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.168 0.894 . . . . 0.0 112.761 -172.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -153.26 130.9 11.51 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.848 -0.532 . . . . 0.0 111.49 175.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.7 mt -100.67 118.98 37.9 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.026 0.93 . . . . 0.0 110.459 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.6 m -68.68 157.33 36.48 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 166.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -40.71 2.38 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 173.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.6 -53.48 54.07 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.646 0.378 . . . . 0.0 111.294 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.77 -44.9 94.97 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.76 -47.72 81.69 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.294 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.14 -58.45 7.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.069 173.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.7 tp -49.52 -55.4 13.5 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 123.337 0.398 . . . . 0.0 111.661 -173.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.271 0.7 OUTLIER -72.21 -32.36 66.7 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.719 -174.886 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.06 -42.85 93.83 Favored 'General case' 0 CA--C 1.523 -0.079 0 CA-C-N 120.065 1.302 . . . . 0.0 109.943 174.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.28 -47.57 81.76 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.954 -0.699 . . . . 0.0 109.928 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.3 m -69.15 -50.5 47.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.606 -173.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -87.59 -38.2 16.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.562 -169.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -117.77 82.38 16.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -38.89 138.24 0.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 125.165 3.91 . . . . 0.0 113.507 169.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m 68.87 -46.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 126.31 1.844 . . . . 0.0 113.325 -175.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.11 -18.45 64.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.303 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.8 mp -14.53 -76.72 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 128.067 2.547 . . . . 0.0 110.879 166.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? 42.94 37.99 1.27 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.562 1.945 . . . . 0.0 113.118 168.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.94 -139.73 5.91 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 -172.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.0 tpp 50.63 -138.7 0.99 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.249 1.019 . . . . 0.0 109.791 -177.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -50.58 -49.09 57.23 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 119.307 0.958 . . . . 0.0 111.362 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -18.59 34.19 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.263 1.025 . . . . 0.0 113.065 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.28 -41.03 71.72 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.155 0.889 . . . . 0.0 109.6 171.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.79 -52.03 65.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.98 -57.0 14.45 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.45 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.22 -53.49 49.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.955 0.502 . . . . 0.0 110.047 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.52 -48.06 75.27 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.303 178.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.49 -42.25 95.94 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.106 0.412 . . . . 0.0 111.321 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.0 -48.19 59.14 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.553 0.692 . . . . 0.0 109.624 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.45 -57.27 10.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.379 1.472 . . . . 0.0 109.557 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -80.33 44.88 0.72 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.73 1.212 . . . . 0.0 112.475 -168.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -56.32 -48.51 76.56 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.071 0.949 . . . . 0.0 111.211 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -109.02 82.25 1.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.832 1.253 . . . . 0.0 108.429 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.47 -42.53 0.33 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 108.875 -1.69 . . . . 0.0 108.875 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 69.29 -59.74 0.48 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.622 2.369 . . . . 0.0 113.686 167.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -98.01 -27.77 8.65 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.846 1.213 . . . . 0.0 112.499 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -136.99 127.71 27.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.236 1.014 . . . . 0.0 109.173 -172.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.2 t -88.69 110.88 21.83 Favored 'Isoleucine or valine' 0 C--N 1.339 0.14 0 C-N-CA 123.903 0.881 . . . . 0.0 108.653 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.7 p -74.32 166.21 23.86 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.941 0.897 . . . . 0.0 110.242 171.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -56.81 -35.86 69.24 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.453 0.644 . . . . 0.0 110.173 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -61.18 -49.48 77.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.083 0.953 . . . . 0.0 110.179 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.33 -44.22 92.2 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.69 176.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -52.69 -40.9 63.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.665 0.786 . . . . 0.0 110.547 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -35.91 46.8 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.102 0.561 . . . . 0.0 112.173 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.16 -38.31 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 118.698 0.681 . . . . 0.0 110.227 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.63 -45.68 74.67 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.215 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.6 t -52.92 -42.2 42.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 O-C-N 121.646 -0.659 . . . . 0.0 111.393 177.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -53.82 -31.01 47.62 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.606 -0.684 . . . . 0.0 112.004 175.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -78.33 -51.64 9.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.909 0.484 . . . . 0.0 109.749 174.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.99 -34.73 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 118.212 0.46 . . . . 0.0 111.531 -176.198 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 m 74.81 -54.06 0.67 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.424 1.89 . . . . 0.0 112.431 171.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.035 -1.46 . . . . 0.0 111.99 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.57 -0.159 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -53.93 48.34 Favored Pre-proline 0 N--CA 1.45 -0.458 0 CA-C-O 117.858 -1.067 . . . . 0.0 112.298 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -47.5 -50.4 11.46 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.319 2.013 . . . . 0.0 112.449 177.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.98 -47.65 83.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.251 0.62 . . . . 0.0 110.826 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -56.41 -50.22 72.24 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.686 0.395 . . . . 0.0 110.094 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.14 -37.2 83.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.058 0.943 . . . . 0.0 109.853 -176.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -58.53 -54.12 50.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.831 0.452 . . . . 0.0 109.805 171.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.17 25.61 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -45.81 -62.81 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.401 1.48 . . . . 0.0 109.818 173.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -45.25 -57.51 3.93 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.49 1.116 . . . . 0.0 110.151 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.09 -48.15 79.3 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.238 -0.411 . . . . 0.0 112.086 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -62.81 -45.93 90.33 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.751 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -56.98 -53.31 59.45 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.732 0.696 . . . . 0.0 111.285 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -46.46 -59.47 2.95 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.319 1.048 . . . . 0.0 110.429 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.49 70.18 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -63.68 -40.88 97.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.452 0.569 . . . . 0.0 111.53 -173.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -134.2 7.87 3.69 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -170.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -162.33 -153.18 7.03 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 119.948 1.249 . . . . 0.0 112.039 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.42 139.0 85.18 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.216 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.1 -1.67 1.86 Allowed 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 123.491 2.794 . . . . 0.0 115.607 -173.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.56 33.13 0.95 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.74 1.154 . . . . 0.0 111.067 169.275 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -146.84 133.25 19.63 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.912 -0.492 . . . . 0.0 112.038 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 27' ' ' GLU . 80.5 mt -96.7 109.34 22.0 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.753 0.821 . . . . 0.0 110.321 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -59.07 164.26 3.12 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.179 0.9 . . . . 0.0 109.316 168.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -48.21 -33.83 9.2 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 169.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -63.23 -51.91 64.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.333 0.515 . . . . 0.0 109.616 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HB3' HD22 ' A' ' 23' ' ' LEU . 1.3 mp0 -57.9 -50.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.2 -45.67 87.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.065 -172.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -58.3 -56.07 26.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.775 -0.578 . . . . 0.0 109.854 171.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -52.4 -53.22 47.92 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.891 0.476 . . . . 0.0 111.523 -172.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.252 0.9 OUTLIER -73.14 -31.73 64.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.523 -176.916 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp -66.39 -42.05 88.48 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 120.886 1.675 . . . . 0.0 109.157 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.8 tm0? -56.59 -51.03 70.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 122.512 0.325 . . . . 0.0 111.643 172.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -70.66 -50.97 31.09 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 118.453 0.569 . . . . 0.0 110.144 -173.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -83.77 -37.61 22.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.841 0.856 . . . . 0.0 111.024 -169.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -128.09 62.92 60.17 Favored Pre-proline 0 C--O 1.235 0.293 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.861 -172.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -60.18 80.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.794 3.662 . . . . 0.0 111.661 -174.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.4 p 177.91 -49.5 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.52 2.328 . . . . 0.0 107.964 -169.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.3 mt -78.36 53.99 1.35 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.426 1.09 . . . . 0.0 111.583 -176.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.414 HD13 ' N ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -156.31 41.29 0.37 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.817 1.247 . . . . 0.0 109.572 175.47 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -67.63 76.16 0.18 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.808 1.243 . . . . 0.0 111.693 -176.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.63 134.74 8.55 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -61.38 -55.8 27.47 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -45.74 -46.93 15.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.942 1.297 . . . . 0.0 111.643 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.13 -28.14 4.07 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 126.372 1.869 . . . . 0.0 113.016 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 23.6 tp -53.4 -39.09 64.02 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.932 0.493 . . . . 0.0 110.198 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.15 -53.08 60.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.323 0.51 . . . . 0.0 110.02 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -66.1 -49.43 67.57 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.959 0.504 . . . . 0.0 109.732 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -54.27 -56.0 22.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -56.43 -46.29 80.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.724 0.809 . . . . 0.0 111.072 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -58.91 -41.45 87.29 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.149 0.431 . . . . 0.0 111.18 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -65.46 -43.36 90.58 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -73.48 -53.73 9.91 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.455 1.502 . . . . 0.0 111.555 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -81.02 51.95 1.67 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.899 1.28 . . . . 0.0 113.784 -167.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -34.75 -61.0 0.42 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 126.195 1.798 . . . . 0.0 113.301 -172.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.14 -41.15 7.25 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.985 0.914 . . . . 0.0 110.694 -173.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.0 -11.31 84.0 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 118.134 -1.37 . . . . 0.0 113.439 -171.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.3 t0 2.23 73.37 0.0 OUTLIER 'General case' 0 C--N 1.348 0.531 0 C-N-CA 129.221 3.008 . . . . 0.0 114.254 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.18 -49.29 0.55 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -169.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -145.62 137.93 25.63 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.093 0.557 . . . . 0.0 111.113 169.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 41.6 t -89.09 119.12 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 C-N-CA 126.635 1.974 . . . . 0.0 109.796 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.2 m -73.49 153.56 40.28 Favored 'General case' 0 C--O 1.228 -0.077 0 C-N-CA 124.967 1.307 . . . . 0.0 109.92 172.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -50.26 -39.96 46.59 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.158 0.504 . . . . 0.0 111.408 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -63.28 -36.41 83.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.399 0.68 . . . . 0.0 110.934 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.32 -44.34 52.92 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -52.42 -40.75 62.54 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 123.256 0.622 . . . . 0.0 110.313 175.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -54.82 -33.59 61.79 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.579 -0.701 . . . . 0.0 111.851 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.71 -42.8 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.375 -0.828 . . . . 0.0 109.322 173.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.46 -47.17 84.92 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 170.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.3 t -54.57 -42.41 59.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.362 0.983 . . . . 0.0 111.68 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.17 -41.84 68.96 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.24 -0.912 . . . . 0.0 110.583 173.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -73.66 -36.62 65.39 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.093 0.957 . . . . 0.0 112.824 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.53 -32.52 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 119.763 1.165 . . . . 0.0 110.034 174.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 m 63.18 43.3 6.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.969 1.708 . . . . 0.0 111.937 171.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 116.964 -1.494 . . . . 0.0 109.149 178.696 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.499 0.19 . . . . 0.0 110.786 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -46.96 -49.37 50.02 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-O 117.411 -1.28 . . . . 0.0 113.701 -169.034 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.56 -49.88 12.51 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.079 1.853 . . . . 0.0 112.944 176.109 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -75.54 -38.82 59.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.783 0.433 . . . . 0.0 110.559 -175.642 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -57.03 -53.21 60.67 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.62 0.724 . . . . 0.0 109.222 175.49 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.1 mt -61.49 -38.49 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.01 0.924 . . . . 0.0 109.739 178.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -57.98 -45.97 85.9 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 119.188 0.903 . . . . 0.0 111.229 172.768 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.01 -54.43 36.98 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 176.49 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.5 mt -51.91 -61.14 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 123.49 0.716 . . . . 0.0 109.452 178.026 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -43.42 -58.58 2.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.231 1.812 . . . . 0.0 109.981 177.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -55.94 -46.97 78.37 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.78 0.832 . . . . 0.0 111.292 -178.504 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -59.97 -47.48 85.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 119.32 -0.371 . . . . 0.0 111.203 179.302 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -61.76 -55.34 31.22 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.471 173.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.56 -51.55 2.93 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.354 1.862 . . . . 0.0 112.226 177.566 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -41.89 -43.07 2.93 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 175.65 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -60.43 -32.5 71.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 111.932 -179.838 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -59.48 -38.91 82.08 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.163 0.985 . . . . 0.0 110.054 174.681 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 -52.64 0.67 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.011 -2.035 . . . . 0.0 108.011 -169.132 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.34 119.64 44.62 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 172.029 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.88 -3.3 11.81 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.437 2.091 . . . . 0.0 113.684 -172.46 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.38 41.12 0.54 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.846 1.203 . . . . 0.0 111.482 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -148.06 129.03 14.44 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.916 -0.49 . . . . 0.0 111.263 174.716 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -94.86 112.12 23.86 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.318 1.047 . . . . 0.0 110.039 -175.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.9 t -73.14 168.32 19.33 Favored 'General case' 0 C--O 1.23 0.051 0 C-N-CA 117.791 -1.563 . . . . 0.0 108.965 167.679 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -38.82 -45.39 1.15 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.716 1.606 . . . . 0.0 111.992 178.595 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.15 -46.32 84.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -62.2 -50.08 73.23 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.325 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.01 -50.52 73.76 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -175.787 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -51.64 -57.15 9.99 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 176.218 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -44.75 95.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -168.479 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.451 HD23 ' C ' ' A' ' 31' ' ' LEU . 4.8 tt -56.26 -57.31 12.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 175.064 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.04 -41.3 78.42 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 121.079 -1.013 . . . . 0.0 112.043 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.19 -49.92 72.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.557 1.071 . . . . 0.0 109.121 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 26.3 m -69.96 -51.12 35.22 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.417 -171.749 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -81.63 -39.08 24.99 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.774 0.83 . . . . 0.0 110.994 -172.578 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -127.93 65.84 69.73 Favored Pre-proline 0 C--O 1.235 0.327 0 CA-C-N 118.593 0.633 . . . . 0.0 110.66 -170.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.59 74.93 0.4 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.575 3.517 . . . . 0.0 111.287 -176.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.5 m -178.29 -43.43 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 129.564 3.146 . . . . 0.0 108.064 -174.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.45 58.85 2.25 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.488 0.715 . . . . 0.0 111.172 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.69 39.36 0.33 Allowed 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 125.535 1.534 . . . . 0.0 109.351 174.51 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -61.95 80.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.071 1.348 . . . . 0.0 111.058 -172.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.5 7.55 27.88 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.296 1.427 . . . . 0.0 113.246 178.068 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 26.6 ttt 61.35 -70.98 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.277 1.831 . . . . 0.0 113.126 175.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 10.0 m -53.04 -31.49 41.69 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.556 1.542 . . . . 0.0 111.675 179.519 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.2 -14.84 0.74 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.521 1.528 . . . . 0.0 113.089 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.5 tp -47.39 -40.46 17.73 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.187 0.903 . . . . 0.0 109.215 167.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -52.22 -54.84 26.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.01 0.368 . . . . 0.0 110.697 177.303 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -63.42 -50.01 71.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.497 0.719 . . . . 0.0 109.759 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 tp -55.63 -53.82 51.76 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.344 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -55.02 -46.25 75.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.914 0.485 . . . . 0.0 109.994 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.42 -45.71 80.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.202 0.455 . . . . 0.0 111.811 -179.183 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -77.01 -36.97 55.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 -176.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.08 -47.02 69.43 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.072 1.349 . . . . 0.0 110.182 -178.24 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.5 64.44 2.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.756 1.222 . . . . 0.0 110.719 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -75.84 70.91 2.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.043 1.337 . . . . 0.0 109.875 178.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 118.17 -140.74 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 130.124 3.37 . . . . 0.0 105.393 -171.536 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.28 -54.12 3.15 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 119.644 1.111 . . . . 0.0 114.067 169.066 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t0 67.07 65.79 0.43 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.767 2.027 . . . . 0.0 110.511 177.126 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.44 4.47 85.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.171 177.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -144.48 121.5 11.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.62 1.168 . . . . 0.0 109.195 178.133 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 115.85 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 125.145 1.378 . . . . 0.0 109.119 -176.204 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.7 p -73.74 163.05 28.49 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 124.109 0.964 . . . . 0.0 111.081 173.079 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.36 -41.03 68.67 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.64 0.376 . . . . 0.0 110.016 177.494 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -57.98 -51.33 70.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.716 0.806 . . . . 0.0 110.914 177.269 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.1 -44.76 96.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -52.11 -41.79 62.74 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.747 0.819 . . . . 0.0 111.317 177.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -52.79 -35.53 56.79 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.8 0.727 . . . . 0.0 112.009 176.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.0 t -57.62 -40.6 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 118.439 0.563 . . . . 0.0 110.104 175.042 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.0 tp -66.28 -45.65 79.73 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.824 -0.547 . . . . 0.0 109.624 172.292 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t -53.22 -42.28 46.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 118.347 0.521 . . . . 0.0 111.284 -178.032 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -52.22 -35.75 50.37 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.182 -0.324 . . . . 0.0 111.781 174.679 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -75.24 -54.7 6.66 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.706 0.403 . . . . 0.0 109.983 174.165 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 pt -56.09 -36.45 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 118.348 0.522 . . . . 0.0 111.355 -172.676 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.4 m 74.19 -49.44 0.67 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.826 1.651 . . . . 0.0 112.598 174.892 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 117.096 -1.43 . . . . 0.0 112.147 178.201 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.5 tttt . . . . . 0 N--CA 1.474 0.728 0 CA-C-O 120.459 0.171 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -55.01 33.33 Favored Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.437 -174.299 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.07 -50.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.519 2.146 . . . . 0.0 112.376 176.463 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.25 -44.67 94.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.136 0.574 . . . . 0.0 110.981 -179.233 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -57.69 -51.15 70.71 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.107 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.7 mt -62.38 -42.17 99.21 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.336 0.654 . . . . 0.0 109.761 -178.072 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -55.01 -51.05 67.47 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.371 0.532 . . . . 0.0 110.766 171.301 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -55.68 26.11 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.46 -59.15 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 C-N-CA 123.907 0.883 . . . . 0.0 109.288 176.43 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -47.28 -55.18 9.19 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.911 1.284 . . . . 0.0 109.741 -179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -57.57 -47.45 82.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.59 0.756 . . . . 0.0 111.076 -176.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.83 -48.85 79.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.775 -178.465 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -57.04 -59.68 4.71 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.348 0.594 . . . . 0.0 111.064 174.021 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.9 -51.46 13.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.889 2.076 . . . . 0.0 112.154 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.29 17.78 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.631 0.772 . . . . 0.0 112.401 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -31.74 67.96 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.983 -0.532 . . . . 0.0 111.929 -178.489 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -159.3 81.2 0.76 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.808 0.813 . . . . 0.0 111.385 -169.459 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 147.87 -83.75 0.18 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 107.362 -2.295 . . . . 0.0 107.362 173.336 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -163.47 156.75 16.34 Favored Pre-proline 0 C--N 1.33 -0.248 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 174.615 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -45.81 -29.22 5.47 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 CA-C-N 122.075 1.777 . . . . 0.0 114.001 169.828 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -96.29 7.46 46.41 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.37 -1.3 . . . . 0.0 114.443 177.833 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -156.79 132.49 9.47 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -168.223 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.8 117.03 32.97 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.865 2.066 . . . . 0.0 111.412 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.3 m -65.49 159.49 24.31 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.022 1.283 . . . . 0.0 111.02 169.094 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 59.3 mtmt -37.99 -53.27 1.37 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.341 1.456 . . . . 0.0 112.867 177.263 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mp0 -65.71 -31.45 72.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 119.5 -0.286 . . . . 0.0 110.406 -175.821 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -73.77 -43.53 58.73 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.346 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.66 -45.96 77.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.566 0.746 . . . . 0.0 109.358 173.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -60.47 -49.05 79.09 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 121.407 -0.808 . . . . 0.0 110.685 173.866 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.99 -60.8 2.47 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 123.548 0.739 . . . . 0.0 111.164 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.251 1.4 pt? -70.94 -33.61 70.66 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.384 -172.123 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -65.43 -42.63 92.26 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.344 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -58.24 -50.34 73.92 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.919 1.236 . . . . 0.0 110.856 173.061 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -62.2 -56.71 15.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 110.498 -173.712 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -84.25 -35.48 23.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.336 1.054 . . . . 0.0 111.604 -170.0 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -134.13 62.45 56.72 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.84 0.856 . . . . 0.0 112.028 -169.881 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -64.97 83.11 0.18 Allowed 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 123.78 2.987 . . . . 0.0 111.556 -174.676 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.0 p 154.55 -28.81 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 129.149 2.979 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 tp -64.2 -35.99 82.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.905 0.775 . . . . 0.0 110.833 -177.57 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.442 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -64.67 -19.34 65.67 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 170.667 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 66.83 -59.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.267 2.227 . . . . 0.0 113.253 179.192 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.71 168.41 41.05 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 47.4 tpp -56.77 -66.61 0.42 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.579 0.752 . . . . 0.0 110.226 -173.666 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.9 m -51.04 -44.94 61.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.702 0.801 . . . . 0.0 110.789 177.316 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -25.71 21.76 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.289 1.436 . . . . 0.0 112.647 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.5 tp -53.37 -43.06 67.49 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.43 0.559 . . . . 0.0 109.6 174.04 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -55.97 -51.15 68.72 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -178.688 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.53 -54.83 33.97 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.168 0.587 . . . . 0.0 109.731 -178.098 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.4 tp -51.43 -58.15 7.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 27.1 t80 -54.86 -43.98 73.57 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.23 1.012 . . . . 0.0 111.214 -179.204 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -57.59 -44.57 85.47 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.199 0.454 . . . . 0.0 111.048 179.537 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -72.02 -43.9 64.28 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 -179.079 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.432 HD11 HD12 ' A' ' 69' ' ' LEU . 2.4 tt -62.04 -59.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.427 1.491 . . . . 0.0 110.253 -176.325 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -78.28 65.28 3.59 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -178.252 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -59.5 -29.85 68.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.324 0.65 . . . . 0.0 111.483 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.65 -25.61 67.48 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.646 0.778 . . . . 0.0 111.984 172.276 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.75 35.96 92.7 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 124.377 0.989 . . . . 0.0 111.881 177.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -79.39 -10.34 59.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 117.133 0.467 . . . . 0.0 111.44 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.39 8.48 83.3 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -175.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -164.92 134.38 3.62 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -173.349 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.443 HG23 ' CE2' ' A' ' 50' ' ' PHE . 55.8 t -88.58 103.73 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 126.623 1.969 . . . . 0.0 108.776 -168.085 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.61 152.82 37.81 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.634 1.174 . . . . 0.0 109.193 175.089 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -51.01 -33.79 26.46 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.74 0.7 . . . . 0.0 111.731 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -55.59 -53.13 60.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.189 0.996 . . . . 0.0 110.584 173.106 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -62.57 -43.28 99.2 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -58.43 -44.65 89.22 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 122.048 -0.407 . . . . 0.0 111.028 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -57.96 -37.48 74.26 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.193 -0.942 . . . . 0.0 111.635 176.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.53 -38.99 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.439 -0.788 . . . . 0.0 109.802 172.089 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.432 HD12 HD11 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -55.7 -50.93 68.97 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.652 -0.655 . . . . 0.0 109.75 169.443 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t -55.67 -39.64 56.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.549 0.74 . . . . 0.0 110.801 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -53.56 -33.94 56.5 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.828 -0.545 . . . . 0.0 111.216 174.486 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -76.12 -52.88 9.19 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.785 0.434 . . . . 0.0 110.005 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -32.25 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.89 -0.506 . . . . 0.0 111.589 -175.726 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.0 m 85.16 -42.14 0.06 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 127.686 2.394 . . . . 0.0 112.512 170.663 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 116.97 -1.491 . . . . 0.0 111.493 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.416 0.151 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -51.11 55.9 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.825 -174.826 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.36 -43.93 46.46 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.356 2.038 . . . . 0.0 112.439 176.054 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.26 -43.75 73.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.189 0.596 . . . . 0.0 109.925 -177.682 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -56.73 -52.26 65.67 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.31 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.7 mt -60.48 -42.12 95.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.992 0.517 . . . . 0.0 109.87 -178.009 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -56.08 -51.51 67.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.293 0.497 . . . . 0.0 110.627 172.534 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.92 37.96 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 9' ' ' ILE . 69.5 mt -50.36 -60.9 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 123.63 0.772 . . . . 0.0 109.047 175.196 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.4 -57.11 4.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.07 1.348 . . . . 0.0 110.576 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.27 -47.86 77.76 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 111.765 179.676 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -59.08 -44.25 91.87 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.997 -0.439 . . . . 0.0 111.784 179.619 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -63.91 -56.26 16.62 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.808 0.731 . . . . 0.0 111.381 173.125 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.476 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -40.97 -46.25 2.77 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.229 1.812 . . . . 0.0 112.68 178.178 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -42.11 -35.76 1.0 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 174.541 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -63.77 -27.94 69.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 111.349 178.754 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.23 5.81 4.14 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.161 1.384 . . . . 0.0 111.498 170.547 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.48 -62.89 3.75 Favored Glycine 0 CA--C 1.527 0.836 0 O-C-N 120.223 -1.548 . . . . 0.0 109.536 -172.706 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.48 113.7 8.88 Favored Pre-proline 0 CA--C 1.535 0.387 0 C-N-CA 123.064 0.546 . . . . 0.0 109.917 177.479 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -79.97 35.81 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.589 2.193 . . . . 0.0 111.94 -173.544 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -159.89 22.19 0.17 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 177.806 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.476 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 2.5 tt0 -151.69 135.67 16.52 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.173 0.589 . . . . 0.0 109.769 -177.995 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.528 HD22 ' HB3' ' A' ' 27' ' ' GLU . 70.3 mt -111.5 123.01 49.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.15 1.38 . . . . 0.0 109.891 -175.099 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -84.44 168.96 15.03 Favored 'General case' 0 C--N 1.335 -0.058 0 CA-C-N 120.431 1.468 . . . . 0.0 109.476 168.927 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -38.48 -47.84 1.32 Allowed 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 126.152 1.781 . . . . 0.0 110.743 178.365 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -51.69 -55.44 19.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.296 0.638 . . . . 0.0 111.513 176.145 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.528 ' HB3' HD22 ' A' ' 23' ' ' LEU . 16.1 mp0 -62.43 -44.77 95.64 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.595 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.26 -47.67 84.47 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.765 -0.159 . . . . 0.0 110.86 -173.234 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -55.36 -55.45 31.38 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 121.211 -0.931 . . . . 0.0 109.531 173.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 tp -51.84 -55.32 20.72 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.718 1.261 . . . . 0.0 110.416 -172.599 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 0.8 OUTLIER -75.35 -32.82 61.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 118.539 -0.743 . . . . 0.0 111.793 -175.487 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.16 -44.25 76.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 120.266 1.394 . . . . 0.0 110.854 178.898 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -51.59 68.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.109 174.6 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 51.5 m -66.3 -52.51 46.57 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 121.163 -0.215 . . . . 0.0 111.279 -171.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.581 0.752 . . . . 0.0 111.347 -170.772 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CD2' HD11 ' A' ' 73' ' ' ILE . 23.6 m-85 -125.05 56.33 13.22 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -169.492 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -40.0 141.88 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.751 2.968 . . . . 0.0 113.515 173.883 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.8 m 73.5 -38.24 0.4 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.337 1.455 . . . . 0.0 113.332 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.73 62.03 1.04 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.605 1.093 . . . . 0.0 110.135 176.204 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 174.18 -12.06 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.242 3.417 . . . . 0.0 111.421 -177.387 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 70.44 -64.13 0.38 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 126.327 1.851 . . . . 0.0 110.668 -178.565 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 173.64 122.23 0.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.964 -0.855 . . . . 0.0 110.964 177.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.4 mpt? 26.46 -92.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 128.448 2.699 . . . . 0.0 114.054 169.129 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.7 m -44.69 -42.13 7.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.065 1.746 . . . . 0.0 113.056 -177.322 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.5 m -54.67 -30.34 55.21 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.052 0.941 . . . . 0.0 111.48 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.84 -33.94 69.17 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.561 176.905 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.24 -43.38 74.54 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.243 0.929 . . . . 0.0 110.422 178.095 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.95 -58.68 4.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.298 0.639 . . . . 0.0 109.472 175.157 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -50.15 -50.03 50.26 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.851 0.86 . . . . 0.0 110.628 -174.531 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -51.32 -39.8 57.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.847 1.659 . . . . 0.0 111.053 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -61.32 -35.26 76.91 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 117.908 0.322 . . . . 0.0 110.727 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.19 -44.94 18.92 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.17 -56.52 20.72 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.022 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -79.86 65.73 5.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.711 0.804 . . . . 0.0 109.87 -172.596 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -54.87 -29.49 55.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.078 0.951 . . . . 0.0 112.018 176.7 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.03 -24.99 66.06 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.835 0.454 . . . . 0.0 112.148 176.04 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.17 74.35 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 123.451 0.548 . . . . 0.0 111.966 -178.464 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -76.49 -18.04 58.96 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.467 0.634 . . . . 0.0 111.717 179.52 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 18.03 79.3 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 108.254 -1.939 . . . . 0.0 108.254 -165.281 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -157.98 154.03 27.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 126.901 2.081 . . . . 0.0 107.745 -169.508 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.7 t -117.98 112.92 40.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 125.681 1.592 . . . . 0.0 108.037 -172.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.6 p -67.52 162.55 23.05 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 123.185 0.594 . . . . 0.0 110.611 175.556 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -54.34 -37.45 64.92 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.608 0.718 . . . . 0.0 110.478 169.592 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -59.46 -56.79 17.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.933 0.893 . . . . 0.0 110.084 177.542 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -59.93 -42.01 93.04 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.433 0.635 . . . . 0.0 110.046 179.163 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -54.74 -47.73 73.46 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 177.114 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.64 -28.27 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.602 -0.686 . . . . 0.0 112.408 178.09 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.4 t -64.24 -50.97 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 169.348 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.43 -39.18 69.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.175 -0.328 . . . . 0.0 111.539 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.0 t -44.8 -38.85 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 124.529 1.132 . . . . 0.0 111.825 175.252 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -59.79 -35.06 73.89 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.066 -0.396 . . . . 0.0 111.432 -179.497 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -79.05 -47.06 16.87 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 172.947 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.418 HD11 ' CD2' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -49.14 -39.44 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 124.955 1.302 . . . . 0.0 110.945 -177.333 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m 72.55 -52.52 0.7 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.934 1.694 . . . . 0.0 112.586 176.266 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.616 -1.183 . . . . 0.0 110.16 174.431 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.3 -48.0 86.95 Favored Pre-proline 0 CA--C 1.538 0.49 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.209 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.13 -43.09 61.52 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.122 1.881 . . . . 0.0 112.231 174.25 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.85 -40.69 83.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.351 0.661 . . . . 0.0 109.669 -178.727 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.68 -53.02 61.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.526 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.19 -37.69 86.27 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.437 -178.96 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -56.42 -50.71 70.84 Favored 'General case' 0 CA--C 1.527 0.07 0 CA-C-N 118.681 0.673 . . . . 0.0 110.296 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.69 -52.85 45.65 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 178.418 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 9' ' ' ILE . 53.8 mt -52.78 -60.1 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.721 0.808 . . . . 0.0 109.362 177.407 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -46.86 -54.35 10.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.699 1.2 . . . . 0.0 109.863 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.13 -51.36 69.6 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.158 0.983 . . . . 0.0 110.679 -178.109 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -58.33 -47.66 83.05 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.913 -0.492 . . . . 0.0 111.557 -179.175 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.411 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.3 m-85 -54.0 -62.17 1.83 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.33 0.586 . . . . 0.0 110.967 171.468 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.54 -45.0 46.95 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.335 -174.887 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.68 -30.82 14.64 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.692 0.797 . . . . 0.0 112.486 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -80.44 -85.54 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 118.111 0.414 . . . . 0.0 110.58 176.09 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -97.57 70.24 2.23 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.37 -0.831 . . . . 0.0 110.037 -168.413 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.22 -75.33 0.11 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 170.654 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -178.75 147.23 0.53 Allowed Pre-proline 0 C--N 1.332 -0.173 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -169.692 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -24.6 -50.39 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 1 C-N-CA 125.426 4.084 . . . . 0.0 115.64 172.752 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -134.18 48.74 2.31 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 173.688 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -146.5 134.94 21.96 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.915 -0.49 . . . . 0.0 111.684 168.519 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.1 mt -101.88 124.97 48.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.58 1.152 . . . . 0.0 111.111 -176.288 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 86.5 p -63.55 164.47 9.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.358 0.981 . . . . 0.0 108.982 167.746 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 4.9 ptpp? -52.32 -38.28 58.13 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.078 -1.014 . . . . 0.0 112.473 169.337 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.39 -49.92 74.95 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.371 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -63.15 -41.92 99.35 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 122.218 -0.302 . . . . 0.0 111.242 178.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.94 -43.61 94.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.33 1.052 . . . . 0.0 109.154 178.866 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -55.91 -58.53 7.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.398 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.27 -60.45 2.12 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.353 1.061 . . . . 0.0 111.561 -173.192 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 13' ' ' TYR . 1.4 pt? -67.35 -33.12 74.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.775 -174.944 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.88 -37.43 86.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.073 174.142 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -63.21 -48.99 75.97 Favored 'General case' 0 CA--C 1.527 0.067 0 CA-C-N 120.206 1.366 . . . . 0.0 109.25 176.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -63.76 -55.57 22.14 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.037 -173.343 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -86.43 -36.08 19.31 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.995 0.918 . . . . 0.0 111.787 -169.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -131.95 60.04 48.73 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 123.756 0.822 . . . . 0.0 112.213 -169.233 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -59.54 157.42 31.89 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.122 1.881 . . . . 0.0 110.147 177.444 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.8 m 70.07 -37.06 0.37 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.308 1.443 . . . . 0.0 113.941 -177.68 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.8 tt -52.27 -40.44 61.76 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.53 1.059 . . . . 0.0 110.932 177.233 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.527 HD13 ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -64.07 -14.29 53.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 176.864 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.0 tptt 64.4 -64.22 0.15 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 127.233 2.213 . . . . 0.0 113.145 -178.34 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.61 147.82 11.76 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.751 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 53.7 ttm -32.7 -61.76 0.26 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.75 2.02 . . . . 0.0 113.463 -171.086 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -45.99 -41.09 11.35 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.177 1.391 . . . . 0.0 112.784 -177.499 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.9 m -55.41 -25.94 38.78 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.072 0.949 . . . . 0.0 111.441 -178.062 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 tp -52.29 -38.57 58.76 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 123.066 0.546 . . . . 0.0 110.403 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -57.21 -54.05 51.14 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.057 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.7 -55.61 18.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.002 -177.21 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tt -49.65 -56.09 11.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.623 1.169 . . . . 0.0 109.678 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.491 ' CE1' HG23 ' A' ' 61' ' ' VAL . 37.2 t80 -58.45 -46.45 86.54 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.197 -0.43 . . . . 0.0 110.76 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -42.7 89.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.589 0.632 . . . . 0.0 111.316 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -70.12 -50.16 43.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.685 0.755 . . . . 0.0 109.611 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.45 -55.05 39.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.471 1.508 . . . . 0.0 109.603 -178.018 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -80.64 46.35 0.86 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.071 1.348 . . . . 0.0 112.245 -169.362 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -44.89 -41.32 7.04 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.68 1.992 . . . . 0.0 114.048 -171.394 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -103.21 -45.18 4.98 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.884 0.874 . . . . 0.0 110.822 -177.454 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.09 -4.98 88.0 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 117.829 -1.54 . . . . 0.0 114.166 -169.742 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -2.39 76.86 0.0 OUTLIER 'General case' 0 C--N 1.348 0.512 0 C-N-CA 129.018 2.927 . . . . 0.0 114.254 178.652 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.15 -47.56 0.63 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -169.328 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -138.99 127.01 22.38 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.499 1.119 . . . . 0.0 110.14 179.178 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.491 HG23 ' CE1' ' A' ' 50' ' ' PHE . 32.9 t -88.48 117.82 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 124.746 1.218 . . . . 0.0 110.345 -177.438 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.2 m -80.89 155.77 26.37 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.54 1.136 . . . . 0.0 110.849 172.383 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -55.54 -33.38 63.77 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.077 0.465 . . . . 0.0 112.091 -178.911 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.55 -47.5 69.96 Favored 'General case' 0 C--O 1.227 -0.092 0 O-C-N 121.592 -0.693 . . . . 0.0 110.714 172.26 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -72.79 -41.26 65.19 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.05 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -53.7 -43.92 69.37 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.981 -0.449 . . . . 0.0 110.494 177.827 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -57.4 -30.79 65.23 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.745 -0.597 . . . . 0.0 112.571 177.406 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.6 t -61.17 -39.83 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.245 0.93 . . . . 0.0 109.63 171.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -46.87 84.52 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.312 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.7 t -54.83 -38.16 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.339 -0.851 . . . . 0.0 111.659 177.812 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -57.76 -39.23 76.93 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.687 -0.633 . . . . 0.0 110.575 173.403 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -71.95 -52.01 19.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.028 0.531 . . . . 0.0 110.471 177.484 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -53.81 -29.75 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.75 0.704 . . . . 0.0 110.574 176.09 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.8 m 77.62 42.98 0.11 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 127.157 2.183 . . . . 0.0 108.584 177.822 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.857 1.663 . . . . 0.0 112.892 177.549 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 118.006 -0.997 . . . . 0.0 112.934 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.54 -48.04 22.11 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.975 1.783 . . . . 0.0 111.965 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.02 -47.65 76.7 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 123.328 0.651 . . . . 0.0 110.08 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -56.72 -50.19 72.94 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 mt -67.05 -37.01 83.29 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.225 0.61 . . . . 0.0 109.752 -175.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -60.32 -47.74 84.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.294 0.497 . . . . 0.0 110.525 172.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -56.18 -55.63 28.4 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -47.65 -63.92 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.657 1.183 . . . . 0.0 109.15 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -43.38 -55.73 3.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.503 1.521 . . . . 0.0 110.777 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.73 -48.59 79.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.956 0.903 . . . . 0.0 110.682 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -60.02 -47.4 86.0 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.048 -0.408 . . . . 0.0 111.009 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.36 -55.89 28.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.211 0.459 . . . . 0.0 110.977 174.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.88 -53.25 6.23 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.391 1.076 . . . . 0.0 112.013 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.428 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 178.231 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 mt -111.95 110.13 20.28 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.049 1.34 . . . . 0.0 111.01 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 m -62.84 159.96 15.55 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.411 -0.805 . . . . 0.0 109.42 167.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 1.2 mptp? -38.61 -50.56 1.61 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 124.305 1.042 . . . . 0.0 112.849 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.62 -41.15 98.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.469 0.176 . . . . 0.0 111.329 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -68.54 -44.79 73.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.88 -52.89 63.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -50.47 -56.27 12.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.153 0.581 . . . . 0.0 109.848 175.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -58.65 -45.91 88.27 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.867 1.267 . . . . 0.0 109.014 -169.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.597 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.2 tt -59.02 -55.45 34.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.79 -37.2 70.8 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.114 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.8 -51.85 66.59 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 119.285 0.948 . . . . 0.0 109.125 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -66.91 -51.76 51.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.416 -172.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -77.86 -40.56 39.74 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.541 0.737 . . . . 0.0 111.629 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 123.765 0.826 . . . . 0.0 112.859 -169.435 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.4 tp . . . . . 0 C--O 1.224 -0.271 0 CA-C-O 119.62 -0.229 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -55.92 -55.39 33.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.174 0.511 . . . . 0.0 110.356 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.09 -50.72 63.09 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.11 -57.09 12.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.827 0.851 . . . . 0.0 109.162 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.476 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.6 t80 -59.69 -43.52 94.03 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 118.072 0.396 . . . . 0.0 110.558 -179.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.97 -43.7 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.12 0.418 . . . . 0.0 111.1 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.71 -53.57 13.09 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.39 0.614 . . . . 0.0 109.548 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.26 -59.71 4.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.103 2.161 . . . . 0.0 109.738 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -81.08 45.15 0.81 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.527 0.731 . . . . 0.0 112.401 -169.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 C-N-CA 124.068 0.947 . . . . 0.0 111.688 -169.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.773 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -127.21 139.27 53.05 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.388 1.475 . . . . 0.0 109.261 -172.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.93 111.02 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 124.943 1.297 . . . . 0.0 107.784 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -75.95 166.54 23.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -57.34 -32.22 66.51 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.32 0.581 . . . . 0.0 110.956 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -53.94 -55.49 26.57 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.866 0.866 . . . . 0.0 110.244 172.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -65.99 -41.27 91.3 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -56.01 -43.18 77.47 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.808 -0.557 . . . . 0.0 111.204 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -56.18 -30.21 61.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.531 -0.731 . . . . 0.0 112.039 176.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.8 -42.63 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.336 0.971 . . . . 0.0 110.283 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.65 -47.01 88.15 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 53.7 t . . . . . 0 CA--C 1.534 0.347 0 O-C-N 121.546 -0.721 . . . . 0.0 111.499 177.716 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 N--CA 1.451 -0.386 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.216 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.87 -48.04 23.48 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.817 1.678 . . . . 0.0 111.976 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.5 mp0 -65.73 -46.6 78.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.487 0.715 . . . . 0.0 110.141 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -57.8 -49.0 78.11 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mp -67.84 -33.01 73.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.523 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.25 -50.29 74.25 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.093 0.86 . . . . 0.0 110.175 169.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.97 -56.96 18.3 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.504 -1.039 . . . . 0.0 110.504 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.9 mt -44.16 -64.98 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.783 1.633 . . . . 0.0 110.01 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -43.14 -54.34 4.49 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.687 1.195 . . . . 0.0 109.662 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -59.1 -53.51 57.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.904 0.882 . . . . 0.0 111.448 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -63.65 -33.2 75.11 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 119.935 -0.706 . . . . 0.0 112.033 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -65.79 -60.62 2.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.853 0.752 . . . . 0.0 110.972 170.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' N ' ' A' ' 22' ' ' GLN . . . -43.9 -41.02 4.92 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 125.614 1.565 . . . . 0.0 112.747 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 174.57 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.401 ' N ' ' HB1' ' A' ' 14' ' ' ALA . 2.0 tt0 . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 119.352 -0.356 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.5 mt -115.94 107.77 15.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.894 0.878 . . . . 0.0 109.949 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.6 t -72.82 166.15 23.49 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 120.113 1.324 . . . . 0.0 109.718 169.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -38.78 -45.75 1.18 Allowed 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.742 1.617 . . . . 0.0 112.168 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.48 -48.54 81.24 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.056 0.389 . . . . 0.0 111.401 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.97 -40.95 75.08 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.24 -47.57 85.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.528 1.131 . . . . 0.0 108.993 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -59.2 -48.73 80.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.123 -0.985 . . . . 0.0 110.573 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.8 tp -52.36 -58.66 5.99 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 121.965 -0.46 . . . . 0.0 110.954 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.261 1.2 pt? -71.8 -33.86 68.91 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.12 -175.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.05 -42.79 93.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.169 1.35 . . . . 0.0 110.325 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -56.27 -53.82 52.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 119.499 1.045 . . . . 0.0 110.695 170.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -64.28 -51.52 63.09 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.413 -170.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -81.33 -40.15 24.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.165 0.986 . . . . 0.0 111.526 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 124.213 1.005 . . . . 0.0 111.631 -170.539 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tt . . . . . 0 C--O 1.222 -0.349 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -56.96 -49.92 74.23 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 110.783 176.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -62.82 -55.09 29.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.331 0.586 . . . . 0.0 109.988 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.0 tp -48.95 -53.24 20.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.41 1.084 . . . . 0.0 109.361 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.36 -47.18 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.03 0.932 . . . . 0.0 110.659 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -55.96 -45.1 78.98 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.129 0.422 . . . . 0.0 110.922 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.27 -41.52 80.95 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.168 0.587 . . . . 0.0 110.851 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.48 -56.56 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 127.251 2.22 . . . . 0.0 109.51 -174.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.63 51.0 1.4 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.674 1.59 . . . . 0.0 111.832 -169.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.4 mttp . . . . . 0 CA--C 1.533 0.298 0 C-N-CA 124.617 1.167 . . . . 0.0 113.049 -169.703 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.64 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -137.44 132.13 32.95 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.068 0.947 . . . . 0.0 110.266 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.0 t -87.93 114.36 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 125.676 1.59 . . . . 0.0 109.167 -175.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.5 m -79.3 159.84 27.05 Favored 'General case' 0 C--N 1.335 -0.063 0 C-N-CA 123.823 0.849 . . . . 0.0 110.819 174.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -53.12 -33.79 53.86 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.478 0.656 . . . . 0.0 111.646 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 mp0 -56.26 -47.35 78.75 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.006 0.922 . . . . 0.0 110.144 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -75.67 -36.08 60.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -58.45 -42.38 87.25 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.61 -0.681 . . . . 0.0 110.33 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -57.15 -33.97 67.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.61 -1.306 . . . . 0.0 111.898 172.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.8 t -63.24 -45.73 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.402 1.001 . . . . 0.0 109.463 171.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.5 tp -51.3 -45.35 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.498 0.59 . . . . 0.0 110.42 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 CA--C 1.536 0.411 0 CA-C-N 118.845 0.748 . . . . 0.0 111.227 179.068 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.35 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.09 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -52.2 -46.17 34.49 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.088 1.859 . . . . 0.0 111.861 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.02 -44.87 79.19 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.764 0.826 . . . . 0.0 110.031 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.13 -50.88 71.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -65.27 -38.56 90.67 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.269 0.628 . . . . 0.0 110.106 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -56.32 -54.51 44.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 170.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.9 -55.09 22.56 Favored Glycine 0 CA--C 1.529 0.908 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.46 -61.5 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.342 1.057 . . . . 0.0 109.521 175.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -45.16 -53.6 7.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.395 1.078 . . . . 0.0 110.654 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -60.85 -48.39 82.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.338 0.655 . . . . 0.0 110.539 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.53 -44.72 93.12 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.893 0.315 . . . . 0.0 111.04 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -58.29 -62.48 1.8 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.758 0.254 . . . . 0.0 110.829 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.48 -52.24 6.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.154 1.382 . . . . 0.0 112.092 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 114.245 -177.551 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.185 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -119.11 116.64 26.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.983 1.713 . . . . 0.0 109.978 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 95.7 p -63.11 169.52 3.38 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.024 -1.047 . . . . 0.0 110.204 169.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -45.73 -43.2 12.68 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.37 -0.832 . . . . 0.0 111.365 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.18 -47.69 73.14 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.226 -0.296 . . . . 0.0 110.412 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.94 -41.74 99.59 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.853 -0.529 . . . . 0.0 109.977 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.5 -49.74 76.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.571 1.548 . . . . 0.0 110.129 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -62.38 -40.77 97.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.121 175.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.9 -57.2 13.55 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 121.531 -0.731 . . . . 0.0 111.098 -178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.4 pt? -69.4 -35.79 76.12 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 119.229 -0.988 . . . . 0.0 112.113 -176.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.86 -40.73 95.6 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 119.453 1.024 . . . . 0.0 110.676 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -57.21 -52.19 66.33 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.468 1.031 . . . . 0.0 110.954 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -61.25 -56.05 25.02 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 110.698 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -83.31 -36.6 24.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.502 1.121 . . . . 0.0 111.799 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 . . . . . 0 CA--C 1.536 0.414 0 C-N-CA 123.678 0.791 . . . . 0.0 112.247 -172.443 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.224 -0.283 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.23 -50.67 68.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.597 0.359 . . . . 0.0 110.414 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.3 mp0 -66.69 -50.24 63.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.3 tt -50.57 -57.98 6.89 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -52.65 -50.73 62.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.258 1.023 . . . . 0.0 110.928 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -54.53 -42.44 70.89 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.848 0.749 . . . . 0.0 111.611 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -72.04 -20.04 61.74 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.52 0.328 . . . . 0.0 111.607 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -90.75 -58.59 2.43 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.922 1.289 . . . . 0.0 110.206 -176.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -78.81 43.32 0.49 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.513 1.925 . . . . 0.0 113.311 -167.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 CA--C 1.535 0.404 0 C-N-CA 124.178 0.991 . . . . 0.0 111.852 -169.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.87 0 CA-C-O 119.419 -0.656 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -138.11 138.49 38.75 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.778 0.831 . . . . 0.0 110.222 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.7 t -88.72 116.61 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 C-N-CA 127.106 2.162 . . . . 0.0 109.826 -172.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.9 p -70.13 168.32 15.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.742 0.817 . . . . 0.0 111.471 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -60.92 -35.56 77.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.596 0.713 . . . . 0.0 109.676 169.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -58.9 -51.99 67.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.005 0.922 . . . . 0.0 109.094 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -65.98 -40.18 91.01 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.359 0.599 . . . . 0.0 110.247 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -60.4 -34.0 73.29 Favored 'General case' 0 C--O 1.216 -0.697 0 O-C-N 121.375 -0.828 . . . . 0.0 111.479 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.6 -35.06 73.58 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.03 -1.669 . . . . 0.0 111.703 170.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.5 t -62.75 -42.39 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 121.038 -1.039 . . . . 0.0 108.739 169.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.51 -43.49 68.34 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.403 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 61.6 t . . . . . 0 CA--C 1.534 0.33 0 CA-C-N 120.139 1.336 . . . . 0.0 110.289 177.76 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 118.231 -0.89 . . . . 0.0 113.221 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.68 -47.81 19.65 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 121.783 1.656 . . . . 0.0 112.323 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -69.62 -43.33 72.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.862 0.465 . . . . 0.0 110.332 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -54.69 -54.46 41.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.086 0.47 . . . . 0.0 109.775 177.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.07 -34.46 76.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.621 -177.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -57.78 -50.12 74.31 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 119.67 1.123 . . . . 0.0 110.558 172.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.23 -53.84 41.67 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 23.4 mt -49.45 -62.27 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -45.99 -57.18 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.007 1.323 . . . . 0.0 111.165 -177.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -66.13 -36.2 82.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.326 -0.369 . . . . 0.0 111.215 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -63.5 -49.21 74.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.672 0.669 . . . . 0.0 110.005 176.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -57.8 -52.65 64.58 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.717 -0.615 . . . . 0.0 111.363 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.61 -57.74 3.95 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.031 0.532 . . . . 0.0 110.626 172.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 123.23 0.612 . . . . 0.0 112.626 177.077 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 CA--C 1.536 0.414 0 CA-C-O 119.45 -0.31 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.6 mt -109.2 108.93 19.74 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.809 1.244 . . . . 0.0 110.532 -173.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.4 t -70.79 165.8 22.35 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 119.43 1.014 . . . . 0.0 110.698 169.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 59.3 mtmt -38.24 -51.22 1.47 Allowed 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 126.222 1.809 . . . . 0.0 112.378 -176.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.0 mp0 -65.41 -39.44 92.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.77 -0.157 . . . . 0.0 110.709 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.74 -42.0 74.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.53 -48.68 80.06 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.574 -0.158 . . . . 0.0 110.574 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.85 -52.17 66.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.301 -0.874 . . . . 0.0 109.433 177.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 tp -51.28 -60.34 3.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 123.349 0.406 . . . . 0.0 110.363 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.281 0.9 OUTLIER -69.94 -32.33 70.54 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 119.126 -1.03 . . . . 0.0 112.467 -173.435 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.81 -44.95 84.1 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 119.962 1.255 . . . . 0.0 110.48 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -48.53 80.46 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.99 0.359 . . . . 0.0 110.289 176.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -64.81 -53.47 46.4 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.428 0.156 . . . . 0.0 110.695 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -83.8 -41.21 17.8 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.237 0.615 . . . . 0.0 111.432 -171.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 CA--C 1.541 0.606 0 CA-C-N 118.55 0.614 . . . . 0.0 111.962 -174.073 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.0 tp . . . . . 0 C--O 1.222 -0.38 0 N-CA-C 109.759 -0.459 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.36 -53.55 52.44 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 118.258 0.481 . . . . 0.0 110.562 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.17 -49.6 64.12 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -55.61 -52.68 62.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 19.1 t80 -57.78 -44.71 86.4 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.533 0.733 . . . . 0.0 110.419 178.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.35 -41.07 88.37 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.069 0.395 . . . . 0.0 111.149 178.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -68.85 -46.6 68.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.671 0.748 . . . . 0.0 109.272 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.77 -54.77 8.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.324 1.45 . . . . 0.0 110.672 -170.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.55 48.23 1.03 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.514 1.126 . . . . 0.0 112.886 -168.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.2 mttp . . . . . 0 CA--C 1.532 0.274 0 C-N-CA 125.429 1.491 . . . . 0.0 112.694 -169.845 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.687 0 N-CA-C 108.431 -1.867 . . . . 0.0 108.431 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -151.77 135.72 16.49 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 112.11 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.2 t -88.08 116.13 29.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 127.269 2.228 . . . . 0.0 110.335 -168.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 89.4 p -67.59 164.69 18.54 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.151 0.98 . . . . 0.0 111.075 175.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -58.92 -37.67 77.19 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.22 0.533 . . . . 0.0 110.368 170.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -56.52 -54.82 41.41 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.193 0.597 . . . . 0.0 110.26 175.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -61.49 -43.43 98.88 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.035 0.445 . . . . 0.0 110.013 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.49 -41.74 77.15 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 122.058 -0.401 . . . . 0.0 111.002 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -58.31 -27.6 64.24 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.119 -0.988 . . . . 0.0 112.345 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.72 -43.02 97.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.633 1.106 . . . . 0.0 109.497 170.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -58.99 -46.75 87.39 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 172.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 CA--C 1.535 0.391 0 O-C-N 120.998 -1.064 . . . . 0.0 111.176 175.361 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.448 -0.564 0 CA-C-O 118.35 -0.833 . . . . 0.0 112.642 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -56.59 -37.33 97.76 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 CA-C-N 120.881 1.35 . . . . 0.0 111.241 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -64.86 -51.54 61.46 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 122.654 0.381 . . . . 0.0 110.904 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -65.66 -38.89 90.59 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.451 -0.781 . . . . 0.0 109.11 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.13 -30.73 71.28 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.254 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -59.32 -46.51 88.38 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 120.346 1.43 . . . . 0.0 109.321 169.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.97 -56.8 16.94 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.5 mt -50.02 -63.18 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 123.391 0.676 . . . . 0.0 109.637 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -43.01 -52.79 5.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.423 1.889 . . . . 0.0 110.675 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.4 -50.57 73.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.221 1.009 . . . . 0.0 110.376 -178.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -60.57 -40.39 91.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.126 -0.359 . . . . 0.0 111.449 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -61.55 -60.8 3.15 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.321 0.509 . . . . 0.0 111.811 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.77 -53.8 2.77 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.924 1.29 . . . . 0.0 111.613 177.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 C-N-CA 124.682 1.193 . . . . 0.0 113.673 -179.513 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 119.554 -0.26 . . . . 0.0 111.611 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 73.4 mt -115.48 108.12 16.06 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.107 1.363 . . . . 0.0 110.311 -178.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -63.63 159.5 18.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.166 -0.959 . . . . 0.0 109.749 168.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -39.18 -46.83 1.53 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.616 1.166 . . . . 0.0 113.071 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -61.09 -43.95 98.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 117.761 0.255 . . . . 0.0 111.389 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -68.69 -42.42 77.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.46 -47.34 85.86 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -56.79 -50.28 72.81 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.484 -0.76 . . . . 0.0 109.709 175.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -53.03 -57.34 10.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.656 0.382 . . . . 0.0 111.627 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.0 OUTLIER -73.44 -33.63 65.02 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 119.286 0.948 . . . . 0.0 112.472 -176.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.18 -38.74 92.37 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 120.691 1.587 . . . . 0.0 109.387 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.24 -50.8 71.59 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.956 -0.465 . . . . 0.0 111.413 171.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -68.57 -47.68 66.19 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.788 -171.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -88.65 -39.52 13.98 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.334 1.053 . . . . 0.0 111.466 -170.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 . . . . . 0 CA--C 1.541 0.629 0 CA-C-N 118.742 0.701 . . . . 0.0 112.689 -171.983 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 tt . . . . . 0 C--O 1.222 -0.388 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -55.28 -54.39 44.09 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.279 0.945 . . . . 0.0 110.505 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mp0 -65.8 -50.81 63.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.41 0.684 . . . . 0.0 109.708 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.7 tp -51.96 -55.59 19.44 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -53.45 -49.07 68.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.119 1.368 . . . . 0.0 110.728 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -53.89 -43.3 69.54 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.735 0.243 . . . . 0.0 111.282 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -76.09 -43.42 43.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 111.277 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 tt -55.48 -56.15 23.58 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.776 1.63 . . . . 0.0 109.435 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -80.24 45.8 0.78 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.098 1.359 . . . . 0.0 113.209 -168.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 tptt . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 122.029 0.919 . . . . 0.0 111.137 -177.145 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.847 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -135.17 133.01 38.69 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.74 1.216 . . . . 0.0 108.448 173.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 29.4 t -86.88 112.33 22.88 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.8 p -78.67 162.19 26.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.547 0.739 . . . . 0.0 109.857 172.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -54.7 -31.61 58.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.311 0.577 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -51.43 -55.97 15.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.819 0.848 . . . . 0.0 110.543 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -72.98 -35.18 66.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -56.85 -42.82 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.698 -0.626 . . . . 0.0 110.663 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.07 -34.43 68.27 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.072 -1.017 . . . . 0.0 111.812 174.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.2 t -61.38 -42.83 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.432 1.014 . . . . 0.0 109.386 172.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.5 -45.99 80.75 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.673 -0.642 . . . . 0.0 109.882 171.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t . . . . . 0 CA--C 1.536 0.423 0 O-C-N 121.097 -1.002 . . . . 0.0 111.378 175.815 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 117.663 -1.161 . . . . 0.0 113.895 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.13 -52.76 8.3 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 121.914 1.743 . . . . 0.0 112.385 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -73.58 -39.39 64.69 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.591 0.356 . . . . 0.0 110.606 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.78 -54.4 44.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 9.2 mp -71.54 -28.04 63.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.86 -175.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.9 -51.2 70.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.437 1.017 . . . . 0.0 108.781 168.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.47 -54.84 27.89 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 176.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.02 -61.27 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.849 0.859 . . . . 0.0 109.789 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -45.88 -54.54 8.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.24 1.416 . . . . 0.0 110.244 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.95 -43.71 98.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -64.76 -43.16 94.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.614 1.097 . . . . 0.0 111.638 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.8 -57.36 12.35 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.299 0.954 . . . . 0.0 111.098 171.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -51.26 7.28 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.322 1.049 . . . . 0.0 111.883 176.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.705 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 . . . . . 0 CA--C 1.535 0.379 0 CA-C-O 119.493 -0.289 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.8 mt -119.57 131.99 55.64 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.814 1.246 . . . . 0.0 110.099 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.4 p -72.92 172.6 10.62 Favored 'General case' 0 C--O 1.224 -0.277 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 167.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -57.03 -33.26 67.01 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 121.072 -1.018 . . . . 0.0 112.26 168.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -65.16 -53.33 46.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.458 0.572 . . . . 0.0 110.134 174.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -61.6 -39.85 92.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.75 -47.69 84.65 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.349 0.659 . . . . 0.0 110.263 175.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -55.57 -48.45 74.78 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.305 -0.872 . . . . 0.0 109.679 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.31 -66.62 0.37 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.578 0.751 . . . . 0.0 110.065 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.265 1.2 pt? -70.21 -29.94 66.91 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.573 -172.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -66.75 -44.5 81.3 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 120.516 1.507 . . . . 0.0 110.581 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.54 -49.39 76.89 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.311 0.505 . . . . 0.0 110.262 174.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.3 m -65.97 -50.89 62.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.171 -173.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -84.41 -40.67 17.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.843 0.857 . . . . 0.0 111.657 -173.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 CA--C 1.542 0.653 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.594 -177.135 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.8 tp . . . . . 0 C--O 1.221 -0.428 0 CA-C-O 119.195 -0.431 . . . . 0.0 110.246 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.55 -58.93 4.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.148 0.499 . . . . 0.0 110.41 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.94 -49.99 70.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.965 0.506 . . . . 0.0 109.737 -175.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -51.57 -55.0 21.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.763 0.825 . . . . 0.0 108.906 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.2 t80 -56.58 -47.39 79.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.645 0.778 . . . . 0.0 110.992 178.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.42 -40.31 86.29 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.543 0.61 . . . . 0.0 111.284 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 68.0 tt0 -68.91 -45.99 69.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.688 0.756 . . . . 0.0 109.269 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.54 -51.51 55.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.554 1.542 . . . . 0.0 110.591 -175.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -74.49 72.35 1.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.725 1.21 . . . . 0.0 109.548 -174.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.2 tttp . . . . . 0 CA--C 1.534 0.337 0 C-N-CA 125.156 1.382 . . . . 0.0 111.506 179.203 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.088 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -154.14 155.72 35.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.948 1.699 . . . . 0.0 107.326 -169.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.8 t -125.2 113.37 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.063 1.345 . . . . 0.0 109.016 -175.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.2 p -69.93 168.09 16.05 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 124.339 1.056 . . . . 0.0 110.857 170.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -56.49 -42.02 77.59 Favored 'General case' 0 C--N 1.342 0.246 0 O-C-N 121.865 -0.522 . . . . 0.0 109.961 169.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -58.89 -49.44 77.77 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.23 0.612 . . . . 0.0 109.585 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.36 -45.99 92.08 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.195 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -52.98 -40.55 63.83 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 122.05 -0.406 . . . . 0.0 111.094 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -55.39 -31.87 62.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.212 -0.93 . . . . 0.0 111.844 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.8 t -64.2 -35.11 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.473 -0.767 . . . . 0.0 110.168 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -66.36 -45.21 80.89 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.475 -0.765 . . . . 0.0 109.143 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 CA--C 1.533 0.307 0 CA-C-N 118.086 0.403 . . . . 0.0 110.813 178.759 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.409 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.636 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -44.64 -40.28 13.93 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.838 2.359 . . . . 0.0 114.163 171.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -71.66 -41.26 68.95 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.178 0.444 . . . . 0.0 109.823 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.57 -51.3 69.11 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.08 -39.3 85.61 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.661 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.48 -51.81 67.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 119.009 0.822 . . . . 0.0 110.443 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.12 -54.56 30.92 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.2 mt -49.78 -63.07 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -43.45 -57.24 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.149 1.38 . . . . 0.0 111.007 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.48 -36.66 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.767 -174.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -62.08 -47.54 84.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.26 0.482 . . . . 0.0 110.786 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -58.43 -55.45 34.89 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.594 0.634 . . . . 0.0 111.008 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -54.26 7.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.617 0.767 . . . . 0.0 111.515 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 178.265 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.222 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -117.24 109.03 16.37 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.41 1.484 . . . . 0.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.1 m -59.75 156.06 14.73 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.856 0.753 . . . . 0.0 109.1 167.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -45.87 -39.89 9.22 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -72.96 -34.02 66.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.02 0.827 . . . . 0.0 111.529 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.88 -49.23 73.52 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 174.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.72 -48.67 77.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.888 -0.507 . . . . 0.0 109.928 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -53.59 -57.67 9.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.133 0.424 . . . . 0.0 110.716 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.26 -33.56 69.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' C ' ' A' ' 31' ' ' LEU . 3.5 tt -56.64 -59.09 5.51 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 169.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -54.66 -42.93 71.92 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.413 -0.805 . . . . 0.0 111.538 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -62.4 -49.7 74.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.432 0.56 . . . . 0.0 110.115 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.0 m -69.51 -48.94 58.91 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.932 0.396 . . . . 0.0 110.023 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -81.85 -41.23 21.31 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 118.318 -0.849 . . . . 0.0 111.742 -169.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 . . . . . 0 CA--C 1.541 0.63 0 CA-C-N 119.273 0.942 . . . . 0.0 112.018 -170.038 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp . . . . . 0 C--O 1.222 -0.374 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -54.17 -53.44 53.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.983 0.42 . . . . 0.0 110.6 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -63.95 -53.59 47.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -51.67 -55.79 17.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.023 0.529 . . . . 0.0 109.714 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 16.9 t80 -55.66 -47.86 75.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.835 0.854 . . . . 0.0 110.754 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -56.42 -39.99 73.97 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.025 0.375 . . . . 0.0 111.932 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -49.07 17.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 109.937 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 tt -62.26 -56.81 14.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.932 1.693 . . . . 0.0 109.615 -174.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -80.87 43.61 0.7 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.965 0.906 . . . . 0.0 112.293 -169.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt . . . . . 0 CA--C 1.533 0.295 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -168.546 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -134.64 141.1 46.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.038 0.935 . . . . 0.0 109.548 173.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.407 HG23 ' CE1' ' A' ' 50' ' ' PHE . 35.5 t -88.55 120.36 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 C-N-CA 125.209 1.404 . . . . 0.0 109.529 -176.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -71.86 163.47 27.77 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 123.946 0.898 . . . . 0.0 111.107 172.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -58.52 -35.13 71.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.861 0.838 . . . . 0.0 109.876 170.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.77 -51.68 68.3 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.439 1.096 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.36 -44.5 94.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.95 0.405 . . . . 0.0 110.123 174.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -53.96 -44.3 70.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.399 0.68 . . . . 0.0 110.889 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -55.03 -31.3 60.97 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.34 -0.85 . . . . 0.0 112.396 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.57 -37.8 79.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 119.013 0.824 . . . . 0.0 110.262 172.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.37 -50.27 70.59 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.2 t . . . . . 0 CA--C 1.533 0.302 0 CA-C-N 117.86 0.3 . . . . 0.0 111.071 -177.097 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.3 0 CA-C-O 118.225 -0.893 . . . . 0.0 112.685 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -49.67 -49.62 15.35 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.367 2.045 . . . . 0.0 112.786 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.05 -39.24 79.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.497 0.319 . . . . 0.0 110.585 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.86 -52.29 65.7 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 174.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 23.3 mt -63.75 -39.58 94.63 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.283 1.033 . . . . 0.0 110.569 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -58.15 -52.86 63.8 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.243 0.617 . . . . 0.0 110.4 172.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.3 -55.14 28.06 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.4 mt -43.62 -64.83 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.028 1.331 . . . . 0.0 109.455 171.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -45.59 -53.29 9.34 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.61 1.164 . . . . 0.0 110.7 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.51 -48.61 80.97 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.903 0.481 . . . . 0.0 110.977 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.96 -43.45 95.04 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 122.004 -0.435 . . . . 0.0 111.167 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -62.02 -58.44 7.84 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 111.081 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.17 -53.07 5.24 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.102 0.961 . . . . 0.0 111.928 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.352 0 C-N-CA 124.376 1.071 . . . . 0.0 113.646 179.658 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.4 mt -112.02 119.04 37.12 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.814 1.646 . . . . 0.0 109.622 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -61.91 169.19 2.71 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.834 1.197 . . . . 0.0 109.752 168.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -52.24 -36.96 53.87 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.004 -1.06 . . . . 0.0 111.875 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.24 -51.06 63.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.16 -41.94 97.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.48 -48.63 80.25 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.867 1.267 . . . . 0.0 109.605 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 tttp -58.38 -51.16 70.99 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -49.03 -61.99 1.77 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.339 1.055 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.277 1.0 OUTLIER -68.09 -32.73 73.25 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.322 -175.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -63.39 -46.77 84.9 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 119.925 1.238 . . . . 0.0 110.449 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -56.09 -52.37 64.55 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.025 173.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.0 m -66.52 -47.97 71.23 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.039 -170.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -87.56 -41.55 13.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.576 0.75 . . . . 0.0 111.981 -172.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 C--O 1.233 0.236 0 CA-C-N 118.67 0.668 . . . . 0.0 110.671 -169.198 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.7 tp . . . . . 0 C--O 1.223 -0.319 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -53.55 -55.55 24.59 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.354 0.597 . . . . 0.0 110.937 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.01 -49.07 63.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.483 0.713 . . . . 0.0 109.45 -174.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.07 -59.13 4.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.698 0.799 . . . . 0.0 108.976 177.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -56.85 -43.68 81.4 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.032 0.533 . . . . 0.0 110.804 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.51 -42.75 78.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.037 0.38 . . . . 0.0 111.19 176.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -71.12 -38.38 72.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.189 0.596 . . . . 0.0 110.174 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.87 -51.21 42.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.934 1.694 . . . . 0.0 110.406 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -78.76 66.95 4.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.016 0.927 . . . . 0.0 109.38 -169.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm . . . . . 0 CA--C 1.533 0.296 0 C-N-CA 126.719 2.007 . . . . 0.0 109.997 179.605 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.082 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -142.93 163.14 33.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.553 1.941 . . . . 0.0 107.017 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.4 t -119.59 115.71 48.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 125.988 1.715 . . . . 0.0 108.243 -173.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.8 p -81.1 163.71 22.95 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 124.238 1.015 . . . . 0.0 110.565 176.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -55.07 -32.95 62.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.119 0.485 . . . . 0.0 111.025 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.99 -34.25 77.15 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.015 0.926 . . . . 0.0 112.069 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -82.74 -42.09 18.43 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -57.6 -44.04 85.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.816 0.846 . . . . 0.0 111.262 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -60.48 -24.67 65.46 Favored 'General case' 0 CA--C 1.529 0.137 0 O-C-N 120.754 -1.216 . . . . 0.0 112.427 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.31 -48.14 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 C-N-CA 119.747 -0.781 . . . . 0.0 108.919 170.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -48.81 -42.48 36.16 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.129 -0.357 . . . . 0.0 110.447 172.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.0 111.792 179.647 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.896 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.89 -48.96 14.75 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.563 2.176 . . . . 0.0 112.38 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.86 -46.49 84.75 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.812 0.845 . . . . 0.0 110.184 -178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -57.5 -48.26 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.4 mt -63.24 -39.73 95.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.735 0.814 . . . . 0.0 110.449 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -54.86 -53.17 58.86 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.517 0.727 . . . . 0.0 109.826 170.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.06 -55.7 26.81 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.0 mt -46.8 -61.25 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 124.302 1.041 . . . . 0.0 109.114 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -46.63 -56.8 5.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.637 0.775 . . . . 0.0 110.964 -178.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -55.04 -47.12 75.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.72 0.408 . . . . 0.0 111.605 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -59.81 -47.18 86.76 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.948 -0.47 . . . . 0.0 111.023 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -61.59 -53.94 49.54 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 118.487 0.585 . . . . 0.0 110.933 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.99 -52.92 8.3 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.302 0.641 . . . . 0.0 112.02 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.478 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 176.805 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 119.612 -0.232 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -114.76 108.35 16.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.377 0.671 . . . . 0.0 110.342 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.7 t -65.77 161.55 20.61 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 168.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 67.4 mttm -38.66 -51.08 1.66 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.625 1.17 . . . . 0.0 113.042 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -66.79 -41.49 87.56 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.63 -42.94 95.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.0 tp -56.2 -61.78 2.16 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 172.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -46.59 -46.15 19.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.538 1.063 . . . . 0.0 111.732 -178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.4 -29.36 68.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.676 1.19 . . . . 0.0 109.741 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.553 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.3 tt -79.32 -58.65 3.11 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 174.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.95 -60.94 1.96 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.928 2.091 . . . . 0.0 111.914 -170.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.18 -46.63 79.29 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -177.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -65.69 -49.61 67.9 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 111.704 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -83.03 -36.09 25.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.08 -171.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 . . . . . 0 CA--C 1.538 0.516 0 C-N-CA 123.583 0.753 . . . . 0.0 110.685 -173.014 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp . . . . . 0 C--O 1.223 -0.336 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -60.29 -46.23 90.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -176.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.39 -54.85 40.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.1 tp -50.36 -55.84 13.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.968 0.507 . . . . 0.0 109.749 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 12.5 t80 -51.16 -48.48 61.85 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.101 0.961 . . . . 0.0 111.074 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.08 -44.52 94.72 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.367 0.53 . . . . 0.0 111.241 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.85 -36.77 80.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.301 0.64 . . . . 0.0 110.814 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.36 -56.81 4.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.985 1.714 . . . . 0.0 109.774 -173.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -80.17 48.75 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.933 1.693 . . . . 0.0 112.605 -168.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -170.288 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -136.36 129.25 31.02 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.633 1.173 . . . . 0.0 109.246 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.37 115.05 27.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -84.23 156.44 22.0 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.994 1.318 . . . . 0.0 109.99 178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -55.23 -31.94 61.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.477 0.656 . . . . 0.0 111.985 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -57.01 -43.97 82.36 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.868 0.867 . . . . 0.0 110.555 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -77.63 -38.71 47.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -59.78 -37.4 78.97 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 121.676 -0.64 . . . . 0.0 110.715 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -56.59 -34.1 66.86 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.303 -1.498 . . . . 0.0 112.117 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -64.09 -44.76 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.283 0.947 . . . . 0.0 109.022 170.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -51.75 -41.82 61.88 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.799 -0.563 . . . . 0.0 110.558 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 CA--C 1.537 0.466 0 CA-C-N 119.339 0.972 . . . . 0.0 111.615 178.199 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.276 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.4 -47.24 28.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.016 1.811 . . . . 0.0 112.046 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -68.04 -43.28 79.06 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.625 0.77 . . . . 0.0 110.02 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.36 -52.02 64.89 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.551 0.74 . . . . 0.0 109.239 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.5 mt -64.25 -37.35 87.18 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.236 0.614 . . . . 0.0 110.427 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -57.96 -48.28 80.42 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.597 0.635 . . . . 0.0 110.312 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.9 -55.56 27.21 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 177.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -50.21 -62.21 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.721 0.808 . . . . 0.0 109.417 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -43.25 -54.53 4.5 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 125.032 1.333 . . . . 0.0 110.443 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.2 -46.82 88.91 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.253 1.021 . . . . 0.0 110.449 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.71 -45.7 93.2 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.226 -0.296 . . . . 0.0 110.927 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -58.14 -58.79 6.89 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.075 0.398 . . . . 0.0 111.396 173.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.77 -53.04 7.82 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.318 1.447 . . . . 0.0 111.724 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 177.228 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 . . . . . 0 N--CA 1.468 0.434 0 N-CA-C 117.453 2.39 . . . . 0.0 117.453 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 59.7 mt -111.23 126.22 54.64 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.3 1.44 . . . . 0.0 110.467 176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.5 p -71.99 171.32 12.05 Favored 'General case' 0 C--O 1.224 -0.249 0 O-C-N 121.307 -0.87 . . . . 0.0 109.513 169.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -47.85 -45.3 30.01 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.104 0.866 . . . . 0.0 111.207 168.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.16 -52.04 65.41 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -61.2 -42.18 98.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.292 0.568 . . . . 0.0 110.361 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.92 -48.95 79.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.77 1.628 . . . . 0.0 109.691 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -59.56 -47.67 84.64 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.343 -0.848 . . . . 0.0 110.272 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.9 tp -52.09 -59.79 3.95 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.016 0.926 . . . . 0.0 111.208 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.3 pt? -68.77 -34.86 76.28 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.82 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.41 -43.45 94.35 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.628 1.104 . . . . 0.0 110.679 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -55.27 -53.98 49.23 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 119.639 1.109 . . . . 0.0 110.466 172.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -65.38 -54.24 31.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.014 -169.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -81.43 -37.63 27.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.475 0.71 . . . . 0.0 111.728 -174.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 . . . . . 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 112.549 -168.596 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.26 -50.16 72.12 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.539 0.336 . . . . 0.0 110.323 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.08 -53.39 50.4 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.468 0.707 . . . . 0.0 109.892 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.3 tp -50.43 -57.72 7.36 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.541 0.736 . . . . 0.0 109.254 178.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -52.73 -48.87 66.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.957 0.903 . . . . 0.0 111.322 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -55.92 -46.13 78.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.538 0.608 . . . . 0.0 111.209 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -71.14 -40.6 71.26 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 121.025 0.441 . . . . 0.0 110.593 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.64 -55.89 25.76 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.305 1.442 . . . . 0.0 109.442 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -80.81 51.72 1.58 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.184 1.794 . . . . 0.0 111.85 -169.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 mttm . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 124.371 1.069 . . . . 0.0 113.412 -169.425 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.748 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -134.0 127.96 33.39 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.736 1.214 . . . . 0.0 108.946 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.7 t -87.26 114.14 25.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 125.236 1.414 . . . . 0.0 108.694 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.5 m -77.75 154.31 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -48.24 -41.01 26.4 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.446 0.641 . . . . 0.0 111.571 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -64.46 -36.09 83.06 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.067 0.547 . . . . 0.0 110.601 -177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -74.75 -44.7 48.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -51.37 -40.62 59.59 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.496 0.718 . . . . 0.0 110.474 174.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -55.37 -32.93 63.0 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.647 -0.658 . . . . 0.0 111.903 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.57 -41.85 91.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.186 -0.946 . . . . 0.0 109.719 172.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.09 -44.32 97.53 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.5 t . . . . . 0 CA--C 1.534 0.341 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 176.927 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.45 -0.443 0 CA-C-O 118.057 -0.973 . . . . 0.0 113.589 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.17 -46.8 21.43 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.814 1.676 . . . . 0.0 112.061 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -72.34 -38.53 68.58 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.801 0.441 . . . . 0.0 110.646 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.72 -55.36 33.12 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.998 -0.438 . . . . 0.0 110.013 174.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.69 -33.53 76.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.3 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -56.9 -50.72 71.67 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.261 0.937 . . . . 0.0 110.517 170.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.65 -52.32 49.04 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -51.95 -62.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.775 0.83 . . . . 0.0 109.519 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -42.47 -55.47 3.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.643 1.177 . . . . 0.0 110.179 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -57.86 -52.45 65.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.904 0.881 . . . . 0.0 111.752 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -62.11 -38.66 89.75 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.769 -0.772 . . . . 0.0 111.72 -176.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -61.98 -60.56 3.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.595 0.634 . . . . 0.0 111.189 169.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.91 -48.14 16.23 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.609 1.564 . . . . 0.0 113.498 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 C-N-CA 124.859 1.264 . . . . 0.0 113.41 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 116.738 2.125 . . . . 0.0 116.738 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.8 mt -113.81 123.12 49.05 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.169 1.788 . . . . 0.0 110.234 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.9 p -66.0 167.23 10.13 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.1 -1.0 . . . . 0.0 110.147 169.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.513 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 60.2 mtpt -43.56 -47.56 7.39 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.38 -0.825 . . . . 0.0 111.709 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -67.25 -46.84 72.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -176.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -62.02 -44.99 95.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.197 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.58 -49.42 77.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.15 -53.8 38.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.934 0.788 . . . . 0.0 110.084 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.28 -51.15 71.17 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.265 1.026 . . . . 0.0 108.531 -170.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.552 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.9 tt -56.58 -55.77 29.74 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.135 -1.393 . . . . 0.0 108.378 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.79 -40.75 73.13 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.981 0.809 . . . . 0.0 111.227 -177.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.7 -49.78 73.73 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.218 0.917 . . . . 0.0 109.076 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.5 m -66.35 -51.51 56.43 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.709 -173.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -83.9 -41.64 17.2 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.259 1.024 . . . . 0.0 111.535 -172.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 . . . . . 0 CA--C 1.539 0.552 0 C-N-CA 124.145 0.978 . . . . 0.0 111.78 -170.217 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp . . . . . 0 C--O 1.22 -0.467 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -56.06 -49.51 73.58 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.037 0.446 . . . . 0.0 109.874 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.09 -54.66 34.38 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.305 0.642 . . . . 0.0 110.125 -179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.4 tp -54.77 -56.04 23.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.513 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 19.2 t80 -52.87 -47.0 68.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.699 1.199 . . . . 0.0 110.782 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -58.38 -41.21 84.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.93 0.332 . . . . 0.0 111.077 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -71.69 -39.23 70.36 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.349 0.595 . . . . 0.0 110.462 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -74.05 -55.44 6.11 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.919 1.688 . . . . 0.0 110.443 -171.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -79.19 40.3 0.41 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.697 1.199 . . . . 0.0 113.814 -167.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.17 0 O-C-N 121.165 -0.96 . . . . 0.0 111.577 -172.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.771 0 N-CA-C 111.866 -0.493 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -138.07 136.78 37.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.189 0.996 . . . . 0.0 109.813 -176.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.76 117.26 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 126.464 1.905 . . . . 0.0 109.186 -172.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -81.66 156.4 25.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.171 0.988 . . . . 0.0 110.343 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -52.9 -38.28 61.57 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 118.589 0.631 . . . . 0.0 111.005 -175.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -61.02 -39.83 91.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.4 0.68 . . . . 0.0 110.379 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.51 -44.36 62.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -54.55 -39.32 67.59 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 122.882 0.473 . . . . 0.0 111.199 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -58.98 -27.5 65.46 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.168 -0.958 . . . . 0.0 111.469 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -63.31 -44.67 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.318 -0.864 . . . . 0.0 109.203 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 16.9 tp -56.3 -47.1 79.34 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 171.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 49.3 t . . . . . 0 CA--C 1.538 0.486 0 CA-C-N 119.765 1.166 . . . . 0.0 111.362 178.456 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 118.358 -0.829 . . . . 0.0 112.762 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.59 -46.22 34.78 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.018 1.812 . . . . 0.0 111.915 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.4 mp0 -67.39 -43.17 81.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.575 0.75 . . . . 0.0 110.264 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.19 -52.18 65.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.87 -37.12 83.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.46 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -56.47 -51.85 66.91 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 119.112 0.869 . . . . 0.0 110.649 171.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.44 -55.02 30.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -49.18 -59.77 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.762 0.825 . . . . 0.0 109.39 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -48.2 -57.91 5.26 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.929 1.292 . . . . 0.0 110.392 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -54.6 -46.42 73.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.302 0.641 . . . . 0.0 111.399 179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -59.29 -48.94 79.72 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.927 -0.483 . . . . 0.0 110.951 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 34.3 m-85 -59.05 -56.82 17.32 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.055 0.388 . . . . 0.0 111.216 175.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.21 -53.93 3.88 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.852 1.261 . . . . 0.0 111.365 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -179.599 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 119.311 -0.376 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' A' ' 27' ' ' GLU . 52.8 mt -107.11 108.91 20.6 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.996 0.918 . . . . 0.0 110.795 -175.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -64.94 163.57 14.26 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.051 -1.03 . . . . 0.0 109.136 167.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -38.63 -42.71 0.81 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.811 1.644 . . . . 0.0 112.073 174.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.48 -45.83 82.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.305 -0.247 . . . . 0.0 111.59 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.453 ' HB3' HD22 ' A' ' 23' ' ' LEU . 15.6 mp0 -62.72 -48.17 80.38 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.18 -47.65 80.69 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.79 0.836 . . . . 0.0 110.376 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -46.87 86.17 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.545 -0.722 . . . . 0.0 109.546 176.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.8 tp -59.37 -52.94 63.47 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.958 -0.464 . . . . 0.0 110.683 -173.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.402 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.259 1.1 pt? -71.37 -34.12 70.15 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.679 -175.184 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 mp -67.14 -42.25 84.73 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.214 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -58.99 -48.51 81.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.228 0.922 . . . . 0.0 111.265 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 m -63.72 -56.38 16.1 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.066 0.46 . . . . 0.0 110.844 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.42 -34.64 18.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.584 1.154 . . . . 0.0 112.495 -168.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 124.16 0.984 . . . . 0.0 111.374 -171.008 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.4 tp . . . . . 0 CA--C 1.517 -0.323 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -51.07 70.77 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.22 -54.46 29.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.7 tp -50.3 -55.61 14.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.486 0.715 . . . . 0.0 109.79 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -53.03 -51.46 61.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.109 0.564 . . . . 0.0 110.331 177.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -57.51 -38.57 74.86 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.434 0.561 . . . . 0.0 112.162 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.19 -33.78 72.15 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.237 0.615 . . . . 0.0 110.195 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -80.39 -56.13 4.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.628 1.171 . . . . 0.0 110.824 -173.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.02 40.87 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.462 1.505 . . . . 0.0 114.816 -166.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -170.625 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.679 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -138.62 134.08 33.28 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.115 0.957 . . . . 0.0 110.579 -175.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.6 t -87.96 119.49 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 124.097 0.959 . . . . 0.0 109.651 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 84.3 p -82.56 158.03 23.27 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.914 0.886 . . . . 0.0 111.132 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -55.61 -37.61 68.37 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.127 0.489 . . . . 0.0 110.801 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -56.59 -47.47 79.5 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.833 1.253 . . . . 0.0 109.973 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.8 -36.98 76.13 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.385 0.612 . . . . 0.0 109.61 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -56.27 -37.52 69.93 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.797 -0.564 . . . . 0.0 110.74 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -55.77 -35.96 66.81 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.645 -1.284 . . . . 0.0 111.896 171.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.56 -48.76 83.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.77 -40.76 30.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.417 0.687 . . . . 0.0 111.583 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.3 t . . . . . 0 N--CA 1.468 0.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.93 175.893 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 117.877 -1.059 . . . . 0.0 113.187 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.45 -47.11 25.95 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.043 1.829 . . . . 0.0 112.552 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.7 -46.14 73.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.365 0.666 . . . . 0.0 109.844 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -55.24 -50.98 68.07 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 109.544 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.92 -37.49 86.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.94 0.896 . . . . 0.0 110.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -57.03 -50.31 73.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.863 0.756 . . . . 0.0 110.353 170.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.17 -55.39 28.5 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 178.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.1 mt -50.93 -58.87 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -46.39 -57.68 4.43 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.988 1.315 . . . . 0.0 111.026 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.39 -37.88 88.3 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.267 0.485 . . . . 0.0 111.071 -175.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -61.79 -43.79 98.15 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.74 -0.6 . . . . 0.0 111.022 177.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -60.02 -58.25 9.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.018 -0.426 . . . . 0.0 111.199 171.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.07 -53.53 4.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.214 1.006 . . . . 0.0 111.492 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.416 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 178.525 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.1 mt -114.62 112.54 23.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.527 1.131 . . . . 0.0 111.58 -175.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.1 p -62.05 165.08 5.93 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.989 -1.069 . . . . 0.0 110.112 168.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -40.67 -46.74 2.66 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 123.915 0.886 . . . . 0.0 111.705 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.61 -52.44 65.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.496 0.318 . . . . 0.0 110.242 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -65.87 -39.75 90.99 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.035 0.445 . . . . 0.0 110.082 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.26 -49.14 78.29 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.81 1.644 . . . . 0.0 109.261 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -58.82 -46.85 86.69 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.386 -0.821 . . . . 0.0 110.315 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.8 tp -52.54 -58.64 6.12 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.41 -0.806 . . . . 0.0 111.824 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.279 1.2 pt? -69.97 -34.74 73.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 119.246 -0.982 . . . . 0.0 112.099 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.3 -42.06 99.0 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 119.535 1.062 . . . . 0.0 110.542 175.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -57.21 -52.91 63.43 Favored 'General case' 0 CA--C 1.527 0.064 0 CA-C-N 119.232 0.924 . . . . 0.0 110.924 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.9 m -62.32 -52.22 64.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.722 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -89.11 -34.96 16.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.07 0.948 . . . . 0.0 112.89 -168.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -168.807 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 tp . . . . . 0 C--O 1.222 -0.345 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -54.16 -51.94 62.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 122.17 0.188 . . . . 0.0 110.955 177.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -64.05 -53.56 47.93 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.328 0.651 . . . . 0.0 110.097 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.9 tp -50.05 -57.44 7.6 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.602 0.761 . . . . 0.0 109.119 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -54.1 -46.26 72.06 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.856 0.863 . . . . 0.0 111.403 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.92 -44.48 86.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.808 0.731 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -72.45 -46.01 56.92 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.868 0.366 . . . . 0.0 110.179 -176.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.06 -59.56 4.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.379 1.472 . . . . 0.0 109.048 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -80.37 47.53 0.93 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.93 1.692 . . . . 0.0 110.556 -173.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ttmm . . . . . 0 CA--C 1.533 0.314 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -167.735 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.683 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -132.39 137.94 47.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.455 1.102 . . . . 0.0 108.582 172.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.1 t -88.22 114.7 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 126.02 1.728 . . . . 0.0 108.569 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.7 p -76.47 159.57 30.29 Favored 'General case' 0 C--N 1.335 -0.047 0 C-N-CA 123.741 0.816 . . . . 0.0 110.53 172.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -55.33 -34.79 64.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.499 0.666 . . . . 0.0 111.174 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.88 -49.44 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.093 0.957 . . . . 0.0 110.393 174.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.65 -40.27 69.8 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -55.22 -41.85 72.58 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 121.796 -0.565 . . . . 0.0 110.601 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -57.59 -31.72 66.47 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.482 -0.761 . . . . 0.0 112.365 176.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.58 -28.84 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.558 -0.714 . . . . 0.0 110.932 171.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -74.08 -45.46 49.1 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.202 -0.936 . . . . 0.0 108.608 169.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 N--CA 1.465 0.287 0 O-C-N 121.267 -0.896 . . . . 0.0 111.76 -178.927 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.387 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.85 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.82 -44.37 31.95 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.266 1.977 . . . . 0.0 112.711 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -71.67 -42.25 67.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.896 0.478 . . . . 0.0 110.312 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.29 -52.08 65.84 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.142 0.496 . . . . 0.0 109.86 174.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.4 mt -64.14 -37.9 89.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.522 0.729 . . . . 0.0 109.826 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -55.88 -52.59 63.56 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 118.292 0.497 . . . . 0.0 110.047 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.01 -55.68 20.12 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.25 -54.75 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -46.25 -54.81 8.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.793 1.237 . . . . 0.0 109.626 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.59 -44.93 93.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.467 0.707 . . . . 0.0 110.824 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -61.25 -45.22 95.42 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 117.957 0.344 . . . . 0.0 111.375 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 30.5 m-85 -60.79 -60.51 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.013 -0.429 . . . . 0.0 111.084 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.35 -49.78 6.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.037 1.735 . . . . 0.0 112.758 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.432 0 C-N-CA 123.956 0.903 . . . . 0.0 113.396 176.753 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 CA--C 1.534 0.353 0 N-CA-C 113.93 1.085 . . . . 0.0 113.93 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.86 152.76 23.47 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 125.889 1.676 . . . . 0.0 107.047 172.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.8 p -94.45 174.07 7.31 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.503 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -53.21 -38.93 63.32 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 119.649 1.113 . . . . 0.0 112.337 167.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.7 -51.88 63.07 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -62.64 -40.42 96.95 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.267 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.84 -49.86 75.79 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.132 0.573 . . . . 0.0 109.476 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -53.89 -51.04 64.98 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.621 -0.674 . . . . 0.0 109.978 175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -51.16 -62.23 1.74 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.416 0.686 . . . . 0.0 111.676 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.408 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.269 1.0 OUTLIER -70.79 -30.64 67.16 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.876 -176.156 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.28 -42.99 96.15 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 120.398 1.453 . . . . 0.0 109.63 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -58.32 -50.54 73.25 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.856 0.753 . . . . 0.0 110.838 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 m -61.15 -56.03 25.48 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.044 0.449 . . . . 0.0 110.719 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -87.13 -40.7 14.39 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.089 1.356 . . . . 0.0 112.078 -169.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 123.872 0.869 . . . . 0.0 111.033 -170.005 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.2 tp . . . . . 0 C--O 1.22 -0.458 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.75 -53.01 60.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.672 0.669 . . . . 0.0 110.495 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -62.5 -58.25 8.28 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.8 mp -53.36 -52.7 58.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 7.6 t80 -57.43 -45.85 84.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.703 0.401 . . . . 0.0 110.641 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -58.28 -41.68 84.9 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.062 0.392 . . . . 0.0 111.336 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -69.89 -44.12 70.4 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.526 0.679 . . . . 0.0 109.768 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.55 -52.22 23.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.272 1.429 . . . . 0.0 110.851 -172.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -75.87 74.4 2.8 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.063 0.945 . . . . 0.0 109.691 -172.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.326 -0.435 0 C-N-CA 124.34 1.056 . . . . 0.0 111.788 174.584 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.166 0 N-CA-C 111.918 -0.473 . . . . 0.0 111.918 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -134.3 168.89 18.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.026 1.33 . . . . 0.0 109.285 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 67.5 t -139.55 109.39 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.05 1.34 . . . . 0.0 107.52 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.7 m -80.71 161.02 24.78 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 122.825 0.45 . . . . 0.0 111.098 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -51.55 -38.97 56.84 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-O 121.423 0.63 . . . . 0.0 110.753 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.09 -38.3 90.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.057 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.27 -45.35 63.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.4 -40.51 62.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.894 0.478 . . . . 0.0 110.966 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -55.52 -30.78 61.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.983 0.513 . . . . 0.0 111.882 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.4 t -61.7 -41.01 88.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 121.371 -0.831 . . . . 0.0 109.645 172.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -48.46 81.61 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 172.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 68.0 t . . . . . 0 CA--C 1.535 0.379 0 O-C-N 121.724 -0.61 . . . . 0.0 111.485 179.465 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.47 -54.3 5.29 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.03 1.82 . . . . 0.0 112.604 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -74.26 -35.96 63.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.387 0.275 . . . . 0.0 111.71 -177.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.97 -56.56 20.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.558 0.694 . . . . 0.0 109.303 176.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.64 -31.31 70.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.298 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.79 -50.24 71.01 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.706 1.139 . . . . 0.0 110.381 169.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.39 -55.41 22.35 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.599 -1.0 . . . . 0.0 110.599 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.403 HD13 HG21 ' A' ' 9' ' ' ILE . 48.5 mt -54.43 -59.12 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -42.32 -54.71 3.65 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.784 1.234 . . . . 0.0 110.539 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.53 -45.04 92.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.707 0.803 . . . . 0.0 110.062 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -59.9 -45.47 92.45 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 122.32 -0.238 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.1 m-85 -61.02 -58.85 6.7 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.15 0.432 . . . . 0.0 111.329 173.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -46.84 7.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.398 1.479 . . . . 0.0 112.748 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.418 0 C-N-CA 124.668 1.187 . . . . 0.0 113.681 176.963 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 . . . . . 0 N--CA 1.456 -0.14 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.2 mt -110.24 110.32 21.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.917 0.887 . . . . 0.0 109.202 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.6 p -69.33 163.54 24.89 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 169.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 99.3 mttt -39.16 -46.09 1.41 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.202 1.001 . . . . 0.0 113.343 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -74.38 -32.63 62.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.191 0.451 . . . . 0.0 112.077 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -69.23 -45.58 69.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.93 -46.22 82.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.264 1.425 . . . . 0.0 109.434 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -57.38 -53.3 59.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 121.585 -0.697 . . . . 0.0 109.75 173.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -54.28 -53.37 54.61 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.878 0.471 . . . . 0.0 111.171 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.285 1.2 pt? -70.89 -35.17 72.21 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 118.903 -1.119 . . . . 0.0 112.081 -176.556 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.63 -36.59 84.13 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 119.591 1.087 . . . . 0.0 110.185 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -51.85 67.28 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.765 0.711 . . . . 0.0 109.808 173.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -63.75 -56.23 17.15 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 110.032 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -83.56 -36.99 23.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.239 1.016 . . . . 0.0 111.842 -169.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -169.764 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.9 tp . . . . . 0 C--O 1.224 -0.24 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -54.01 -55.75 24.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.205 0.202 . . . . 0.0 110.861 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.63 -47.99 68.03 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -173.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 77.3 mt -50.91 -61.95 1.9 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 12.7 t80 -55.22 -44.37 75.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.323 0.51 . . . . 0.0 111.267 -178.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -56.64 -43.8 80.67 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.348 0.259 . . . . 0.0 111.085 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -72.21 -43.37 64.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.465 0.65 . . . . 0.0 109.863 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.73 -51.53 54.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.985 1.714 . . . . 0.0 110.562 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -77.3 71.87 3.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 109.673 -172.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 125.573 1.549 . . . . 0.0 111.956 178.515 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -147.95 160.67 42.57 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.47 1.908 . . . . 0.0 107.315 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 42.4 t -116.43 115.39 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 125.54 1.536 . . . . 0.0 108.098 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.8 p -73.6 166.61 22.95 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.392 1.077 . . . . 0.0 110.622 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -53.2 -43.65 67.35 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.115 0.483 . . . . 0.0 110.156 171.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -64.16 -46.82 82.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 122.932 0.493 . . . . 0.0 109.724 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.94 -47.01 88.39 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.25 0.548 . . . . 0.0 109.652 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -54.1 -39.89 66.8 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.857 0.863 . . . . 0.0 111.181 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -56.2 -27.34 54.28 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.422 -0.799 . . . . 0.0 111.902 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.85 -46.86 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 119.102 0.865 . . . . 0.0 109.189 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -40.53 69.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.417 0.687 . . . . 0.0 109.856 174.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.4 t . . . . . 0 CA--C 1.543 0.691 0 O-C-N 121.378 -0.826 . . . . 0.0 112.173 174.747 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 CA-C-O 117.665 -1.159 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -40.58 -45.57 4.57 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.032 2.488 . . . . 0.0 114.622 170.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -72.4 -42.5 65.08 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.886 0.766 . . . . 0.0 110.297 -176.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -57.08 -51.73 68.11 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.71 -41.28 90.46 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.088 0.955 . . . . 0.0 110.268 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.72 -51.36 69.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.334 0.516 . . . . 0.0 110.046 173.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.54 -56.75 18.45 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 177.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.89 -58.63 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 123.952 0.901 . . . . 0.0 109.289 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -47.57 -55.55 9.0 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.479 1.512 . . . . 0.0 110.402 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.65 -45.71 88.73 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.132 0.573 . . . . 0.0 111.618 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -58.92 -49.17 78.83 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.131 -0.355 . . . . 0.0 110.827 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 24.7 m-85 -58.29 -56.45 21.97 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.013 -0.43 . . . . 0.0 111.197 174.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.02 -51.68 7.63 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.704 1.202 . . . . 0.0 112.48 177.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.455 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 177.486 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 119.643 -0.218 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.6 mt -120.39 129.9 54.13 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.83 1.252 . . . . 0.0 107.911 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 t -93.55 168.07 11.27 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 167.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -48.14 -34.62 10.18 Favored 'General case' 0 N--CA 1.461 0.125 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -170.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -70.5 -40.63 73.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.959 -0.463 . . . . 0.0 110.742 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.4 -42.42 75.12 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.51 -48.56 80.44 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 122.435 0.294 . . . . 0.0 110.987 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -62.69 -42.43 99.63 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 118.031 -1.468 . . . . 0.0 109.207 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.1 tp -54.49 -59.17 5.05 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.99 -0.444 . . . . 0.0 111.192 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.254 1.3 pt? -70.28 -35.33 73.65 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 119.032 -1.067 . . . . 0.0 112.245 -174.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -42.51 98.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 119.414 1.006 . . . . 0.0 110.119 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.22 -48.48 81.55 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.275 0.943 . . . . 0.0 111.11 173.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -61.19 -55.95 26.28 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.043 0.449 . . . . 0.0 110.562 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -87.1 -38.68 16.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.451 1.1 . . . . 0.0 112.069 -169.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 CA--C 1.535 0.37 0 C-N-CA 124.118 0.967 . . . . 0.0 111.758 -170.878 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.0 tp . . . . . 0 C--O 1.222 -0.382 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.74 -51.91 67.05 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.28 0.491 . . . . 0.0 110.014 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -66.9 -49.48 65.45 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.777 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.1 tp -54.51 -53.28 56.46 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -54.92 -47.89 73.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.486 0.714 . . . . 0.0 110.624 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -58.4 -40.44 82.42 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.168 0.44 . . . . 0.0 111.305 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.23 -47.8 63.73 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 121.668 0.747 . . . . 0.0 109.33 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -64.57 -57.45 9.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.609 1.563 . . . . 0.0 110.537 -174.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -74.34 75.18 1.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 tttp . . . . . 0 CA--C 1.537 0.447 0 C-N-CA 124.651 1.18 . . . . 0.0 111.504 178.489 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.145 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -142.22 160.76 39.6 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.182 0.993 . . . . 0.0 110.102 -176.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.46 103.95 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 76.5 p -68.15 173.6 4.56 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.355 0.662 . . . . 0.0 109.454 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -58.36 -35.87 72.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.737 0.78 . . . . 0.0 110.343 171.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -62.54 -51.69 66.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.857 0.863 . . . . 0.0 109.727 178.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.95 -46.29 88.38 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.02 -41.5 71.4 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.51 -0.744 . . . . 0.0 111.559 -177.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -56.54 -27.81 58.53 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.455 -0.778 . . . . 0.0 112.584 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.53 -35.98 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 119.432 1.015 . . . . 0.0 110.484 170.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.88 -48.76 73.1 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 171.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 63.8 t . . . . . 0 CA--C 1.532 0.277 0 O-C-N 122.112 -0.368 . . . . 0.0 111.03 178.461 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.378 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.72 -46.68 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.098 1.866 . . . . 0.0 112.109 175.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -68.85 -41.96 77.77 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.307 0.643 . . . . 0.0 110.064 -177.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.22 -52.11 65.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.03 -34.08 76.93 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 119.405 -0.331 . . . . 0.0 110.405 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -59.14 -51.06 71.66 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.708 0.685 . . . . 0.0 110.57 169.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.75 -54.19 34.72 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.4 mt -44.61 -64.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 125.084 1.354 . . . . 0.0 109.651 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -45.25 -53.96 7.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.74 0.816 . . . . 0.0 110.443 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.16 -49.95 74.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.934 0.894 . . . . 0.0 111.863 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.16 -45.57 92.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.529 1.058 . . . . 0.0 110.944 -179.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -58.74 -53.55 57.11 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.88 -0.513 . . . . 0.0 110.759 177.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -53.93 19.32 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.889 1.276 . . . . 0.0 111.463 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.313 0 O-C-N 121.406 -0.808 . . . . 0.0 112.105 172.654 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.1 mt -106.65 127.76 53.62 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 125.62 1.568 . . . . 0.0 109.535 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.2 p -71.92 171.4 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.287 -0.883 . . . . 0.0 109.044 168.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 8.4 mtmp? -45.86 -44.61 14.49 Favored 'General case' 0 C--O 1.226 -0.173 0 O-C-N 121.637 -0.664 . . . . 0.0 110.969 167.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mp0 -68.39 -47.69 66.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.746 0.418 . . . . 0.0 109.936 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -61.62 -41.74 97.9 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.48 -48.77 80.38 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.702 1.201 . . . . 0.0 109.851 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -59.87 -48.9 79.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.228 -0.92 . . . . 0.0 110.093 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.4 tp -50.98 -60.86 2.64 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.88 0.872 . . . . 0.0 111.244 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 1.1 pt? -69.18 -31.67 70.45 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 119.063 -1.055 . . . . 0.0 112.199 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -65.92 -43.55 87.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 119.994 1.27 . . . . 0.0 110.55 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -55.84 -54.02 49.59 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.013 0.824 . . . . 0.0 110.677 171.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.0 m -65.67 -52.71 49.52 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.564 0.221 . . . . 0.0 111.289 -169.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -80.56 -39.05 28.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.634 0.773 . . . . 0.0 111.346 -175.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 . . . . . 0 CA--C 1.538 0.511 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.364 -169.803 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp . . . . . 0 C--O 1.223 -0.321 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -52.84 -57.2 11.0 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.087 0.47 . . . . 0.0 109.92 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.49 -52.26 64.19 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.336 0.655 . . . . 0.0 110.114 -175.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.18 -54.5 35.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.755 0.822 . . . . 0.0 109.141 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.468 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 38.5 t80 -57.79 -45.3 86.23 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.038 0.535 . . . . 0.0 111.337 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.91 -42.94 95.01 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.144 0.884 . . . . 0.0 111.105 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.19 -50.52 67.77 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.807 0.813 . . . . 0.0 109.266 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -60.08 4.4 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 126.328 1.851 . . . . 0.0 109.715 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -80.35 49.82 1.19 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.908 1.683 . . . . 0.0 112.407 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? . . . . . 0 CA--C 1.534 0.355 0 CA-C-O 121.315 0.579 . . . . 0.0 109.797 -177.798 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.951 0 CA-C-O 119.695 -0.503 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -143.64 131.68 21.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.985 0.914 . . . . 0.0 110.411 -177.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 37.9 t -87.43 113.77 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 C-N-CA 127.303 2.241 . . . . 0.0 108.349 -171.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 96.7 p -79.72 165.68 22.57 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.095 0.558 . . . . 0.0 110.359 173.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -55.42 -33.94 63.98 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.917 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.96 -54.82 29.36 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.413 0.685 . . . . 0.0 110.226 173.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -69.11 -38.63 79.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -58.44 -39.51 80.03 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 121.763 -0.586 . . . . 0.0 110.778 179.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -57.62 -35.17 70.12 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.464 1.484 . . . . 0.0 111.967 174.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.98 -39.57 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 121.205 -0.935 . . . . 0.0 109.3 171.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.39 -43.85 88.69 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 169.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.7 t . . . . . 0 CA--C 1.532 0.272 0 CA-C-N 119.587 1.085 . . . . 0.0 110.731 178.556 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.456 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.62 -40.79 30.68 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.54 2.16 . . . . 0.0 113.294 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -71.1 -46.19 62.22 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.115 0.566 . . . . 0.0 109.994 -176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -58.37 -50.78 72.42 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.38 -40.81 95.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.997 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -56.96 -50.88 71.29 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 118.556 0.616 . . . . 0.0 110.527 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.67 -54.47 32.78 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 9' ' ' ILE . 57.1 mt -50.01 -64.36 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 123.93 0.892 . . . . 0.0 109.352 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -45.73 -52.19 11.39 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.18 1.392 . . . . 0.0 110.239 -178.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.82 -45.96 91.56 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.626 1.171 . . . . 0.0 110.457 -175.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.29 -49.04 79.19 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.252 -0.28 . . . . 0.0 110.557 178.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -56.28 -60.54 3.36 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 117.972 0.351 . . . . 0.0 111.388 175.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.28 -55.12 3.46 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.923 1.689 . . . . 0.0 111.914 177.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 . . . . . 0 CA--C 1.539 0.542 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.4 mt -119.99 135.19 55.01 Favored 'General case' 0 C--N 1.345 0.402 0 C-N-CA 125.658 1.583 . . . . 0.0 109.575 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.9 p -74.13 172.67 11.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.105 0.866 . . . . 0.0 109.181 168.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -55.33 -38.42 68.71 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.041 -1.037 . . . . 0.0 112.152 168.306 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.31 -52.41 64.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.84 -40.78 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.55 -47.31 86.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.368 1.067 . . . . 0.0 110.027 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -57.24 -51.44 69.36 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.664 -0.815 . . . . 0.0 109.536 172.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.1 tp -52.6 -55.86 19.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.629 0.372 . . . . 0.0 111.773 -173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.26 1.3 pt? -69.85 -35.55 74.82 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 119.143 -1.023 . . . . 0.0 112.249 -177.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -64.77 -40.4 95.2 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 120.562 1.528 . . . . 0.0 109.936 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.34 -52.18 65.53 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.007 0.523 . . . . 0.0 111.003 171.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.55 -49.6 58.24 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 -172.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -86.47 -37.5 18.21 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.173 0.989 . . . . 0.0 111.589 -169.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 . . . . . 0 CA--C 1.539 0.55 0 C-N-CA 124.22 1.008 . . . . 0.0 111.649 -175.145 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp . . . . . 0 C--O 1.223 -0.305 0 CA-C-O 119.131 -0.461 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.48 -55.39 32.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -60.82 -53.74 53.71 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.069 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.48 -54.57 39.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.793 0.837 . . . . 0.0 109.183 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' A' ' 61' ' ' VAL . 41.2 t80 -57.51 -45.42 84.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.515 0.726 . . . . 0.0 111.196 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -61.18 -45.03 96.29 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 118.799 0.727 . . . . 0.0 110.89 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.13 -47.07 84.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.559 0.695 . . . . 0.0 109.346 -176.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -61.2 2.52 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.887 1.675 . . . . 0.0 109.77 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -80.58 54.99 2.2 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.476 1.51 . . . . 0.0 111.75 -168.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 mttp . . . . . 0 C--N 1.33 -0.239 0 C-N-CA 123.214 0.605 . . . . 0.0 111.396 -174.86 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.759 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -138.76 128.93 25.52 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.561 1.144 . . . . 0.0 109.691 179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.52 HG23 ' CE1' ' A' ' 50' ' ' PHE . 66.3 t -87.37 99.8 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 -178.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.3 m -68.53 155.52 39.79 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -46.5 -36.99 7.25 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.542 0.686 . . . . 0.0 112.178 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -60.62 -41.19 94.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.718 0.807 . . . . 0.0 110.927 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -72.34 -40.84 67.09 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 174.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.4 -42.63 64.19 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.708 -0.62 . . . . 0.0 110.961 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -39.74 20.09 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.667 -0.645 . . . . 0.0 112.494 172.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.1 t -61.42 -39.84 84.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 O-C-N 121.746 -0.596 . . . . 0.0 110.149 175.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.44 -51.63 69.07 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t . . . . . 0 CA--C 1.533 0.292 0 CA-C-N 117.929 0.331 . . . . 0.0 111.057 -176.461 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 117.695 -1.145 . . . . 0.0 112.403 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -50.75 11.14 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.367 2.045 . . . . 0.0 112.315 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.64 -48.04 82.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.192 0.597 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.04 -50.17 71.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.764 0.426 . . . . 0.0 109.852 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.65 -38.7 92.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.108 0.963 . . . . 0.0 109.593 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -59.56 -52.37 65.83 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.271 0.487 . . . . 0.0 110.387 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.51 -54.22 36.06 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.8 mt -45.19 -64.32 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.558 1.143 . . . . 0.0 109.497 172.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -48.21 -56.13 8.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.463 1.505 . . . . 0.0 110.534 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -56.91 -47.02 81.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.56 0.344 . . . . 0.0 110.889 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -60.51 -44.17 96.29 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.984 -0.448 . . . . 0.0 111.113 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -59.66 -57.28 13.62 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 118.161 0.437 . . . . 0.0 111.132 174.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -50.52 13.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.776 0.83 . . . . 0.0 111.633 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.392 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.707 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 119.712 -0.185 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.7 mt -100.67 118.98 37.9 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.026 0.93 . . . . 0.0 110.459 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.6 m -68.68 157.33 36.48 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 166.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -40.71 2.38 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 173.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.6 -53.48 54.07 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.646 0.378 . . . . 0.0 111.294 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.77 -44.9 94.97 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.76 -47.72 81.69 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.294 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.14 -58.45 7.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.069 173.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.7 tp -49.52 -55.4 13.5 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 123.337 0.398 . . . . 0.0 111.661 -173.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.271 0.7 OUTLIER -72.21 -32.36 66.7 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.719 -174.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.06 -42.85 93.83 Favored 'General case' 0 CA--C 1.523 -0.079 0 CA-C-N 120.065 1.302 . . . . 0.0 109.943 174.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.28 -47.57 81.76 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.954 -0.699 . . . . 0.0 109.928 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.3 m -69.15 -50.5 47.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.606 -173.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -87.59 -38.2 16.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.562 -169.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 . . . . . 0 CA--C 1.541 0.632 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -167.482 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 tp . . . . . 0 C--O 1.224 -0.254 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.79 -52.03 65.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.98 -57.0 14.45 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.45 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.22 -53.49 49.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.955 0.502 . . . . 0.0 110.047 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.52 -48.06 75.27 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.303 178.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.49 -42.25 95.94 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.106 0.412 . . . . 0.0 111.321 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.0 -48.19 59.14 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.553 0.692 . . . . 0.0 109.624 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.45 -57.27 10.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.379 1.472 . . . . 0.0 109.557 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -80.33 44.88 0.72 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.73 1.212 . . . . 0.0 112.475 -168.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? . . . . . 0 CA--C 1.531 0.224 0 C-N-CA 124.071 0.949 . . . . 0.0 111.211 -172.132 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.854 0 CA-C-O 119.496 -0.613 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -136.99 127.71 27.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.236 1.014 . . . . 0.0 109.173 -172.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.2 t -88.69 110.88 21.83 Favored 'Isoleucine or valine' 0 C--N 1.339 0.14 0 C-N-CA 123.903 0.881 . . . . 0.0 108.653 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.7 p -74.32 166.21 23.86 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.941 0.897 . . . . 0.0 110.242 171.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -56.81 -35.86 69.24 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.453 0.644 . . . . 0.0 110.173 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -61.18 -49.48 77.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.083 0.953 . . . . 0.0 110.179 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.33 -44.22 92.2 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.69 176.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -52.69 -40.9 63.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.665 0.786 . . . . 0.0 110.547 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -35.91 46.8 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.102 0.561 . . . . 0.0 112.173 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.16 -38.31 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 118.698 0.681 . . . . 0.0 110.227 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.63 -45.68 74.67 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 CA--C 1.534 0.354 0 O-C-N 121.646 -0.659 . . . . 0.0 111.393 177.892 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 117.858 -1.067 . . . . 0.0 112.298 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -47.5 -50.4 11.46 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.319 2.013 . . . . 0.0 112.449 177.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.98 -47.65 83.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.251 0.62 . . . . 0.0 110.826 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -56.41 -50.22 72.24 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.686 0.395 . . . . 0.0 110.094 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.14 -37.2 83.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.058 0.943 . . . . 0.0 109.853 -176.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -58.53 -54.12 50.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.831 0.452 . . . . 0.0 109.805 171.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.17 25.61 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -45.81 -62.81 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.401 1.48 . . . . 0.0 109.818 173.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -45.25 -57.51 3.93 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.49 1.116 . . . . 0.0 110.151 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.09 -48.15 79.3 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.238 -0.411 . . . . 0.0 112.086 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -62.81 -45.93 90.33 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.751 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -56.98 -53.31 59.45 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.732 0.696 . . . . 0.0 111.285 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -46.46 -59.47 2.95 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.319 1.048 . . . . 0.0 110.429 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.233 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.873 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.531 0.245 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 27' ' ' GLU . 80.5 mt -96.7 109.34 22.0 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.753 0.821 . . . . 0.0 110.321 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -59.07 164.26 3.12 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.179 0.9 . . . . 0.0 109.316 168.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -48.21 -33.83 9.2 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 169.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -63.23 -51.91 64.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.333 0.515 . . . . 0.0 109.616 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HB3' HD22 ' A' ' 23' ' ' LEU . 1.3 mp0 -57.9 -50.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.2 -45.67 87.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.065 -172.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -58.3 -56.07 26.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.775 -0.578 . . . . 0.0 109.854 171.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -52.4 -53.22 47.92 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.891 0.476 . . . . 0.0 111.523 -172.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.252 0.9 OUTLIER -73.14 -31.73 64.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.523 -176.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp -66.39 -42.05 88.48 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 120.886 1.675 . . . . 0.0 109.157 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -51.03 70.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 122.512 0.325 . . . . 0.0 111.643 172.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -70.66 -50.97 31.09 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 118.453 0.569 . . . . 0.0 110.144 -173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -83.77 -37.61 22.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.841 0.856 . . . . 0.0 111.024 -169.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 . . . . . 0 C--O 1.235 0.293 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.861 -172.818 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 23.6 tp . . . . . 0 C--O 1.224 -0.27 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.15 -53.08 60.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.323 0.51 . . . . 0.0 110.02 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -66.1 -49.43 67.57 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.959 0.504 . . . . 0.0 109.732 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -54.27 -56.0 22.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -56.43 -46.29 80.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.724 0.809 . . . . 0.0 111.072 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -58.91 -41.45 87.29 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.149 0.431 . . . . 0.0 111.18 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -65.46 -43.36 90.58 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -73.48 -53.73 9.91 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.455 1.502 . . . . 0.0 111.555 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -81.02 51.95 1.67 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.899 1.28 . . . . 0.0 113.784 -167.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? . . . . . 0 N--CA 1.466 0.363 0 C-N-CA 126.195 1.798 . . . . 0.0 113.301 -172.305 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.633 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -145.62 137.93 25.63 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.093 0.557 . . . . 0.0 111.113 169.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 41.6 t -89.09 119.12 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 C-N-CA 126.635 1.974 . . . . 0.0 109.796 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.2 m -73.49 153.56 40.28 Favored 'General case' 0 C--O 1.228 -0.077 0 C-N-CA 124.967 1.307 . . . . 0.0 109.92 172.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -50.26 -39.96 46.59 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.158 0.504 . . . . 0.0 111.408 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -63.28 -36.41 83.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.399 0.68 . . . . 0.0 110.934 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.32 -44.34 52.92 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -52.42 -40.75 62.54 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 123.256 0.622 . . . . 0.0 110.313 175.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -54.82 -33.59 61.79 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.579 -0.701 . . . . 0.0 111.851 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.71 -42.8 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.375 -0.828 . . . . 0.0 109.322 173.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.46 -47.17 84.92 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 170.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.3 t . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 119.362 0.983 . . . . 0.0 111.68 179.889 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 117.411 -1.28 . . . . 0.0 113.701 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.56 -49.88 12.51 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.079 1.853 . . . . 0.0 112.944 176.109 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -75.54 -38.82 59.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.783 0.433 . . . . 0.0 110.559 -175.642 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -57.03 -53.21 60.67 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.62 0.724 . . . . 0.0 109.222 175.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.1 mt -61.49 -38.49 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.01 0.924 . . . . 0.0 109.739 178.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -57.98 -45.97 85.9 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 119.188 0.903 . . . . 0.0 111.229 172.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.01 -54.43 36.98 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 176.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.5 mt -51.91 -61.14 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 123.49 0.716 . . . . 0.0 109.452 178.026 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -43.42 -58.58 2.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.231 1.812 . . . . 0.0 109.981 177.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -55.94 -46.97 78.37 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.78 0.832 . . . . 0.0 111.292 -178.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -59.97 -47.48 85.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 119.32 -0.371 . . . . 0.0 111.203 179.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -61.76 -55.34 31.22 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.471 173.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.56 -51.55 2.93 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.354 1.862 . . . . 0.0 112.226 177.566 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.52 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 175.65 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 111.263 0.098 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -94.86 112.12 23.86 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.318 1.047 . . . . 0.0 110.039 -175.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.9 t -73.14 168.32 19.33 Favored 'General case' 0 C--O 1.23 0.051 0 C-N-CA 117.791 -1.563 . . . . 0.0 108.965 167.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -38.82 -45.39 1.15 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.716 1.606 . . . . 0.0 111.992 178.595 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.15 -46.32 84.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -62.2 -50.08 73.23 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.01 -50.52 73.76 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -175.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -51.64 -57.15 9.99 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 176.218 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -44.75 95.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -168.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.451 HD23 ' C ' ' A' ' 31' ' ' LEU . 4.8 tt -56.26 -57.31 12.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 175.064 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.04 -41.3 78.42 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 121.079 -1.013 . . . . 0.0 112.043 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.19 -49.92 72.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.557 1.071 . . . . 0.0 109.121 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 26.3 m -69.96 -51.12 35.22 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.417 -171.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -81.63 -39.08 24.99 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.774 0.83 . . . . 0.0 110.994 -172.578 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 . . . . . 0 C--O 1.235 0.327 0 CA-C-N 118.593 0.633 . . . . 0.0 110.66 -170.262 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.5 tp . . . . . 0 C--O 1.222 -0.371 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -52.22 -54.84 26.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.01 0.368 . . . . 0.0 110.697 177.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -63.42 -50.01 71.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.497 0.719 . . . . 0.0 109.759 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 tp -55.63 -53.82 51.76 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.344 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -55.02 -46.25 75.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.914 0.485 . . . . 0.0 109.994 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.42 -45.71 80.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.202 0.455 . . . . 0.0 111.811 -179.183 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -77.01 -36.97 55.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 -176.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.08 -47.02 69.43 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.072 1.349 . . . . 0.0 110.182 -178.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.5 64.44 2.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.756 1.222 . . . . 0.0 110.719 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 CA--C 1.533 0.322 0 C-N-CA 125.043 1.337 . . . . 0.0 109.875 178.926 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.981 0 CA-C-O 119.767 -0.463 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -144.48 121.5 11.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.62 1.168 . . . . 0.0 109.195 178.133 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 115.85 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 125.145 1.378 . . . . 0.0 109.119 -176.204 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.7 p -73.74 163.05 28.49 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 124.109 0.964 . . . . 0.0 111.081 173.079 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.36 -41.03 68.67 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.64 0.376 . . . . 0.0 110.016 177.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -57.98 -51.33 70.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.716 0.806 . . . . 0.0 110.914 177.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.1 -44.76 96.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -52.11 -41.79 62.74 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.747 0.819 . . . . 0.0 111.317 177.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -52.79 -35.53 56.79 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.8 0.727 . . . . 0.0 112.009 176.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.0 t -57.62 -40.6 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 118.439 0.563 . . . . 0.0 110.104 175.042 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.0 tp -66.28 -45.65 79.73 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.824 -0.547 . . . . 0.0 109.624 172.292 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 CA--C 1.536 0.405 0 CA-C-N 118.347 0.521 . . . . 0.0 111.284 -178.032 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.437 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.07 -50.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.519 2.146 . . . . 0.0 112.376 176.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.25 -44.67 94.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.136 0.574 . . . . 0.0 110.981 -179.233 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -57.69 -51.15 70.71 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.107 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.7 mt -62.38 -42.17 99.21 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.336 0.654 . . . . 0.0 109.761 -178.072 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -55.01 -51.05 67.47 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.371 0.532 . . . . 0.0 110.766 171.301 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -55.68 26.11 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.46 -59.15 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 C-N-CA 123.907 0.883 . . . . 0.0 109.288 176.43 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -47.28 -55.18 9.19 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.911 1.284 . . . . 0.0 109.741 -179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -57.57 -47.45 82.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.59 0.756 . . . . 0.0 111.076 -176.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.83 -48.85 79.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.775 -178.465 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -57.04 -59.68 4.71 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.348 0.594 . . . . 0.0 111.064 174.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.9 -51.46 13.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.889 2.076 . . . . 0.0 112.154 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.234 0 C-N-CA 123.631 0.772 . . . . 0.0 112.401 177.014 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 . . . . . 0 CA--C 1.551 1.007 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.8 117.03 32.97 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.865 2.066 . . . . 0.0 111.412 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.3 m -65.49 159.49 24.31 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.022 1.283 . . . . 0.0 111.02 169.094 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 59.3 mtmt -37.99 -53.27 1.37 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.341 1.456 . . . . 0.0 112.867 177.263 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mp0 -65.71 -31.45 72.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 119.5 -0.286 . . . . 0.0 110.406 -175.821 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -73.77 -43.53 58.73 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.66 -45.96 77.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.566 0.746 . . . . 0.0 109.358 173.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -60.47 -49.05 79.09 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 121.407 -0.808 . . . . 0.0 110.685 173.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.99 -60.8 2.47 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 123.548 0.739 . . . . 0.0 111.164 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.251 1.4 pt? -70.94 -33.61 70.66 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.384 -172.123 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -65.43 -42.63 92.26 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.344 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -58.24 -50.34 73.92 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.919 1.236 . . . . 0.0 110.856 173.061 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -62.2 -56.71 15.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 110.498 -173.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -84.25 -35.48 23.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.336 1.054 . . . . 0.0 111.604 -170.0 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 123.84 0.856 . . . . 0.0 112.028 -169.881 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.5 tp . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -55.97 -51.15 68.72 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -178.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.53 -54.83 33.97 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.168 0.587 . . . . 0.0 109.731 -178.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.4 tp -51.43 -58.15 7.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 27.1 t80 -54.86 -43.98 73.57 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.23 1.012 . . . . 0.0 111.214 -179.204 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -57.59 -44.57 85.47 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.199 0.454 . . . . 0.0 111.048 179.537 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -72.02 -43.9 64.28 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 -179.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.432 HD11 HD12 ' A' ' 69' ' ' LEU . 2.4 tt -62.04 -59.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.427 1.491 . . . . 0.0 110.253 -176.325 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -78.28 65.28 3.59 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -178.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.6 pttm . . . . . 0 CA--C 1.534 0.35 0 C-N-CA 123.324 0.65 . . . . 0.0 111.483 -179.641 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.894 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -164.92 134.38 3.62 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -173.349 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.443 HG23 ' CE2' ' A' ' 50' ' ' PHE . 55.8 t -88.58 103.73 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 126.623 1.969 . . . . 0.0 108.776 -168.085 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.61 152.82 37.81 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.634 1.174 . . . . 0.0 109.193 175.089 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -51.01 -33.79 26.46 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.74 0.7 . . . . 0.0 111.731 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -55.59 -53.13 60.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.189 0.996 . . . . 0.0 110.584 173.106 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -62.57 -43.28 99.2 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -58.43 -44.65 89.22 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 122.048 -0.407 . . . . 0.0 111.028 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -57.96 -37.48 74.26 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.193 -0.942 . . . . 0.0 111.635 176.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.53 -38.99 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.439 -0.788 . . . . 0.0 109.802 172.089 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.432 HD12 HD11 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -55.7 -50.93 68.97 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.652 -0.655 . . . . 0.0 109.75 169.443 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t . . . . . 0 CA--C 1.53 0.198 0 C-N-CA 123.549 0.74 . . . . 0.0 110.801 -179.569 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.825 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.36 -43.93 46.46 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.356 2.038 . . . . 0.0 112.439 176.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.26 -43.75 73.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.189 0.596 . . . . 0.0 109.925 -177.682 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -56.73 -52.26 65.67 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.7 mt -60.48 -42.12 95.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.992 0.517 . . . . 0.0 109.87 -178.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -56.08 -51.51 67.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.293 0.497 . . . . 0.0 110.627 172.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.92 37.96 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 9' ' ' ILE . 69.5 mt -50.36 -60.9 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 123.63 0.772 . . . . 0.0 109.047 175.196 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.4 -57.11 4.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.07 1.348 . . . . 0.0 110.576 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.27 -47.86 77.76 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 111.765 179.676 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -59.08 -44.25 91.87 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.997 -0.439 . . . . 0.0 111.784 179.619 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -63.91 -56.26 16.62 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.808 0.731 . . . . 0.0 111.381 173.125 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.97 -46.25 2.77 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.229 1.812 . . . . 0.0 112.68 178.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 174.541 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.528 HD22 ' HB3' ' A' ' 27' ' ' GLU . 70.3 mt -111.5 123.01 49.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.15 1.38 . . . . 0.0 109.891 -175.099 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -84.44 168.96 15.03 Favored 'General case' 0 C--N 1.335 -0.058 0 CA-C-N 120.431 1.468 . . . . 0.0 109.476 168.927 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -38.48 -47.84 1.32 Allowed 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 126.152 1.781 . . . . 0.0 110.743 178.365 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -51.69 -55.44 19.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.296 0.638 . . . . 0.0 111.513 176.145 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.528 ' HB3' HD22 ' A' ' 23' ' ' LEU . 16.1 mp0 -62.43 -44.77 95.64 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.595 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.26 -47.67 84.47 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.765 -0.159 . . . . 0.0 110.86 -173.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -55.36 -55.45 31.38 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 121.211 -0.931 . . . . 0.0 109.531 173.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 tp -51.84 -55.32 20.72 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.718 1.261 . . . . 0.0 110.416 -172.599 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 0.8 OUTLIER -75.35 -32.82 61.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 118.539 -0.743 . . . . 0.0 111.793 -175.487 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.16 -44.25 76.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 120.266 1.394 . . . . 0.0 110.854 178.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -51.59 68.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.109 174.6 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 51.5 m -66.3 -52.51 46.57 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 121.163 -0.215 . . . . 0.0 111.279 -171.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.581 0.752 . . . . 0.0 111.347 -170.772 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -169.492 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.24 -43.38 74.54 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.243 0.929 . . . . 0.0 110.422 178.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.95 -58.68 4.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.298 0.639 . . . . 0.0 109.472 175.157 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -50.15 -50.03 50.26 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.851 0.86 . . . . 0.0 110.628 -174.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -51.32 -39.8 57.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.847 1.659 . . . . 0.0 111.053 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -61.32 -35.26 76.91 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 117.908 0.322 . . . . 0.0 110.727 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.19 -44.94 18.92 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.17 -56.52 20.72 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.022 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -79.86 65.73 5.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.711 0.804 . . . . 0.0 109.87 -172.596 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? . . . . . 0 CA--C 1.536 0.426 0 C-N-CA 124.078 0.951 . . . . 0.0 112.018 176.7 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.44 0 N-CA-C 108.254 -1.939 . . . . 0.0 108.254 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -157.98 154.03 27.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 126.901 2.081 . . . . 0.0 107.745 -169.508 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.7 t -117.98 112.92 40.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 125.681 1.592 . . . . 0.0 108.037 -172.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.6 p -67.52 162.55 23.05 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 123.185 0.594 . . . . 0.0 110.611 175.556 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -54.34 -37.45 64.92 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.608 0.718 . . . . 0.0 110.478 169.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -59.46 -56.79 17.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.933 0.893 . . . . 0.0 110.084 177.542 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -59.93 -42.01 93.04 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.433 0.635 . . . . 0.0 110.046 179.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -54.74 -47.73 73.46 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 177.114 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.64 -28.27 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.602 -0.686 . . . . 0.0 112.408 178.09 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.4 t -64.24 -50.97 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 169.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.43 -39.18 69.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.175 -0.328 . . . . 0.0 111.539 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.0 t . . . . . 0 CA--C 1.536 0.427 0 C-N-CA 124.529 1.132 . . . . 0.0 111.825 175.252 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.13 -43.09 61.52 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.122 1.881 . . . . 0.0 112.231 174.25 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.85 -40.69 83.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.351 0.661 . . . . 0.0 109.669 -178.727 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.68 -53.02 61.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.526 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.19 -37.69 86.27 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.437 -178.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -56.42 -50.71 70.84 Favored 'General case' 0 CA--C 1.527 0.07 0 CA-C-N 118.681 0.673 . . . . 0.0 110.296 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.69 -52.85 45.65 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 178.418 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 9' ' ' ILE . 53.8 mt -52.78 -60.1 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.721 0.808 . . . . 0.0 109.362 177.407 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -46.86 -54.35 10.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.699 1.2 . . . . 0.0 109.863 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.13 -51.36 69.6 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.158 0.983 . . . . 0.0 110.679 -178.109 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -58.33 -47.66 83.05 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.913 -0.492 . . . . 0.0 111.557 -179.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.411 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.3 m-85 -54.0 -62.17 1.83 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.33 0.586 . . . . 0.0 110.967 171.468 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.54 -45.0 46.95 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.335 -174.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.323 0 C-N-CA 123.692 0.797 . . . . 0.0 112.486 177.74 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.537 0.444 0 N-CA-C 111.684 0.253 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.1 mt -101.88 124.97 48.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.58 1.152 . . . . 0.0 111.111 -176.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 86.5 p -63.55 164.47 9.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.358 0.981 . . . . 0.0 108.982 167.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 4.9 ptpp? -52.32 -38.28 58.13 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.078 -1.014 . . . . 0.0 112.473 169.337 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.39 -49.92 74.95 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.371 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -63.15 -41.92 99.35 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 122.218 -0.302 . . . . 0.0 111.242 178.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.94 -43.61 94.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.33 1.052 . . . . 0.0 109.154 178.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -55.91 -58.53 7.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.27 -60.45 2.12 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.353 1.061 . . . . 0.0 111.561 -173.192 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 13' ' ' TYR . 1.4 pt? -67.35 -33.12 74.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.775 -174.944 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.88 -37.43 86.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.073 174.142 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -63.21 -48.99 75.97 Favored 'General case' 0 CA--C 1.527 0.067 0 CA-C-N 120.206 1.366 . . . . 0.0 109.25 176.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -63.76 -55.57 22.14 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.037 -173.343 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -86.43 -36.08 19.31 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.995 0.918 . . . . 0.0 111.787 -169.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 123.756 0.822 . . . . 0.0 112.213 -169.233 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 tp . . . . . 0 C--O 1.224 -0.265 0 CA-C-O 119.588 -0.244 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -57.21 -54.05 51.14 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.057 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.7 -55.61 18.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.002 -177.21 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tt -49.65 -56.09 11.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.623 1.169 . . . . 0.0 109.678 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.491 ' CE1' HG23 ' A' ' 61' ' ' VAL . 37.2 t80 -58.45 -46.45 86.54 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.197 -0.43 . . . . 0.0 110.76 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -42.7 89.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.589 0.632 . . . . 0.0 111.316 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -70.12 -50.16 43.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.685 0.755 . . . . 0.0 109.611 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.45 -55.05 39.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.471 1.508 . . . . 0.0 109.603 -178.018 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -80.64 46.35 0.86 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.071 1.348 . . . . 0.0 112.245 -169.362 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 pttt . . . . . 0 CA--C 1.533 0.306 0 C-N-CA 126.68 1.992 . . . . 0.0 114.048 -171.394 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -138.99 127.01 22.38 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.499 1.119 . . . . 0.0 110.14 179.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.491 HG23 ' CE1' ' A' ' 50' ' ' PHE . 32.9 t -88.48 117.82 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 124.746 1.218 . . . . 0.0 110.345 -177.438 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.2 m -80.89 155.77 26.37 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.54 1.136 . . . . 0.0 110.849 172.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -55.54 -33.38 63.77 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.077 0.465 . . . . 0.0 112.091 -178.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.55 -47.5 69.96 Favored 'General case' 0 C--O 1.227 -0.092 0 O-C-N 121.592 -0.693 . . . . 0.0 110.714 172.26 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -72.79 -41.26 65.19 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -53.7 -43.92 69.37 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.981 -0.449 . . . . 0.0 110.494 177.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -57.4 -30.79 65.23 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.745 -0.597 . . . . 0.0 112.571 177.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.6 t -61.17 -39.83 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.245 0.93 . . . . 0.0 109.63 171.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -46.87 84.52 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.312 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.7 t . . . . . 0 CA--C 1.536 0.439 0 O-C-N 121.339 -0.851 . . . . 0.0 111.659 177.812 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.7 tptt . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 110.903 -0.036 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -51.46 59.48 Favored Pre-proline 0 N--CA 1.452 -0.335 0 CA-C-O 118.006 -0.997 . . . . 0.0 112.934 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.54 -48.04 22.11 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.975 1.783 . . . . 0.0 111.965 178.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -65.02 -47.65 76.7 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 123.328 0.651 . . . . 0.0 110.08 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -56.72 -50.19 72.94 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 mt -67.05 -37.01 83.29 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.225 0.61 . . . . 0.0 109.752 -175.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -60.32 -47.74 84.75 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 118.294 0.497 . . . . 0.0 110.525 172.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -56.18 -55.63 28.4 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.67 -0.972 . . . . 0.0 110.67 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 38.7 mt -47.65 -63.92 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.657 1.183 . . . . 0.0 109.15 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -43.38 -55.73 3.95 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.503 1.521 . . . . 0.0 110.777 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.73 -48.59 79.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.956 0.903 . . . . 0.0 110.682 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -60.02 -47.4 86.0 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 122.048 -0.408 . . . . 0.0 111.009 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -59.36 -55.89 28.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.211 0.459 . . . . 0.0 110.977 174.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.481 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.88 -53.25 6.23 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.391 1.076 . . . . 0.0 112.013 178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.8 -32.8 3.93 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.903 1.075 . . . . 0.0 113.903 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -58.1 -33.68 69.36 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 111.161 177.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -86.12 18.57 3.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.334 1.054 . . . . 0.0 111.31 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.46 -61.79 3.53 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -178.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -55.34 111.05 2.63 Favored Pre-proline 0 CA--C 1.536 0.428 0 C-N-CA 124.017 0.927 . . . . 0.0 109.25 176.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.17 -13.88 28.55 Favored 'Trans proline' 0 N--CA 1.453 -0.889 0 C-N-CA 122.104 1.869 . . . . 0.0 112.545 -173.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -121.4 22.42 10.75 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 118.493 -0.765 . . . . 0.0 112.967 -169.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.481 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -156.35 140.99 16.93 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -174.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.8 mt -111.95 110.13 20.28 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.049 1.34 . . . . 0.0 111.01 -178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.0 m -62.84 159.96 15.55 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.411 -0.805 . . . . 0.0 109.42 167.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 1.2 mptp? -38.61 -50.56 1.61 Allowed 'General case' 0 C--N 1.341 0.205 0 C-N-CA 124.305 1.042 . . . . 0.0 112.849 177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -63.62 -41.15 98.32 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 120.469 0.176 . . . . 0.0 111.329 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -68.54 -44.79 73.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 -178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.88 -52.89 63.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -50.47 -56.27 12.29 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.153 0.581 . . . . 0.0 109.848 175.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 60.6 tp -58.65 -45.91 88.27 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.867 1.267 . . . . 0.0 109.014 -169.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.597 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.2 tt -59.02 -55.45 34.98 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.6 mp -56.79 -37.2 70.8 Favored 'General case' 0 C--O 1.226 -0.175 0 CA-C-O 118.733 -0.651 . . . . 0.0 112.114 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.8 -51.85 66.59 Favored 'General case' 0 C--O 1.227 -0.1 0 CA-C-N 119.285 0.948 . . . . 0.0 109.125 177.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 18.1 m -66.91 -51.76 51.37 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.416 -172.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -77.86 -40.56 39.74 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.541 0.737 . . . . 0.0 111.629 -175.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -133.74 62.6 59.42 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 123.765 0.826 . . . . 0.0 112.859 -169.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_exo -39.24 -36.24 0.82 Allowed 'Trans proline' 0 C--N 1.349 0.562 1 C-N-CA 125.894 4.396 . . . . 0.0 117.977 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 p -98.46 -19.62 17.57 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.572 1.549 . . . . 0.0 112.545 -173.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.8 tt -59.8 -39.63 85.61 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 119.269 0.94 . . . . 0.0 110.539 -171.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.586 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -61.17 -21.4 63.75 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 175.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.3 ttpm? 62.98 -65.8 0.1 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 126.576 1.95 . . . . 0.0 112.661 -175.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -151.65 133.49 4.22 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 108.01 -2.036 . . . . 0.0 108.01 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.5 mmt -34.38 -54.26 0.52 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.371 1.869 . . . . 0.0 114.185 -169.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -44.41 -40.26 5.31 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.47 1.508 . . . . 0.0 113.106 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.8 m -52.6 -25.72 11.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.509 1.124 . . . . 0.0 111.747 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.4 tp -49.25 -38.91 28.39 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 123.538 0.735 . . . . 0.0 110.573 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -55.92 -55.39 33.23 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 121.174 0.511 . . . . 0.0 110.356 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -66.09 -50.72 63.09 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.7 tp -54.11 -57.09 12.4 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.827 0.851 . . . . 0.0 109.162 -178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.476 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.6 t80 -59.69 -43.52 94.03 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 118.072 0.396 . . . . 0.0 110.558 -179.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.97 -43.7 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.12 0.418 . . . . 0.0 111.1 178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -71.71 -53.57 13.09 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.39 0.614 . . . . 0.0 109.548 -177.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 tt -55.26 -59.71 4.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.103 2.161 . . . . 0.0 109.738 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -81.08 45.15 0.81 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.527 0.731 . . . . 0.0 112.401 -169.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -49.08 67.13 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.068 0.947 . . . . 0.0 111.688 -169.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.83 13.86 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.107 0.563 . . . . 0.0 111.231 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.61 -34.88 56.26 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-O 119.266 -0.741 . . . . 0.0 112.918 -169.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.9 t70 66.43 -57.67 0.37 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.806 2.042 . . . . 0.0 113.849 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.21 -51.33 3.77 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 124.472 1.034 . . . . 0.0 111.635 -178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -127.21 139.27 53.05 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.388 1.475 . . . . 0.0 109.261 -172.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 25.6 t -87.93 111.02 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 124.943 1.297 . . . . 0.0 107.784 179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.5 p -75.95 166.54 23.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 171.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 42.9 t80 -57.34 -32.22 66.51 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 121.32 0.581 . . . . 0.0 110.956 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -53.94 -55.49 26.57 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.866 0.866 . . . . 0.0 110.244 172.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -65.99 -41.27 91.3 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -56.01 -43.18 77.47 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.808 -0.557 . . . . 0.0 111.204 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -56.18 -30.21 61.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.531 -0.731 . . . . 0.0 112.039 176.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.8 -42.63 89.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 119.336 0.971 . . . . 0.0 110.283 170.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -60.65 -47.01 88.15 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.59 -42.94 62.82 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 121.546 -0.721 . . . . 0.0 111.499 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -57.5 -26.74 61.76 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.407 -0.808 . . . . 0.0 112.127 175.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -76.69 -53.12 8.41 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.931 0.787 . . . . 0.0 110.106 169.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -56.04 -33.01 34.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 CA-C-N 118.542 0.61 . . . . 0.0 111.656 -175.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.4 m 76.25 -44.16 0.48 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.595 1.958 . . . . 0.0 112.453 173.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? . . . . . 0 C--O 1.251 1.18 0 CA-C-O 117.413 -1.28 . . . . 0.0 110.479 174.709 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.8 tttt . . . . . 0 N--CA 1.473 0.686 0 N-CA-C 110.355 -0.239 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -53.91 -48.17 94.61 Favored Pre-proline 0 N--CA 1.451 -0.386 0 CA-C-O 117.754 -1.117 . . . . 0.0 113.216 -175.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -51.87 -48.04 23.48 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.817 1.678 . . . . 0.0 111.976 176.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.5 mp0 -65.73 -46.6 78.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.487 0.715 . . . . 0.0 110.141 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -57.8 -49.0 78.11 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.3 mp -67.84 -33.01 73.94 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 119.075 -0.488 . . . . 0.0 110.523 -177.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -60.25 -50.29 74.25 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 119.093 0.86 . . . . 0.0 110.175 169.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.97 -56.96 18.3 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 110.504 -1.039 . . . . 0.0 110.504 178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.9 mt -44.16 -64.98 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.156 0 C-N-CA 125.783 1.633 . . . . 0.0 110.01 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 39.1 t80 -43.14 -54.34 4.49 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.687 1.195 . . . . 0.0 109.662 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -59.1 -53.51 57.57 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 123.904 0.882 . . . . 0.0 111.448 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.9 pttm -63.65 -33.2 75.11 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 119.935 -0.706 . . . . 0.0 112.033 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -65.79 -60.62 2.7 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.853 0.752 . . . . 0.0 110.972 170.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' N ' ' A' ' 22' ' ' GLN . . . -43.9 -41.02 4.92 Favored 'General case' 0 C--O 1.223 -0.293 0 C-N-CA 125.614 1.565 . . . . 0.0 112.747 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -42.62 -36.18 1.32 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 174.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -74.19 -27.43 60.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.113 0.869 . . . . 0.0 112.058 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -68.31 157.6 35.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.213 1.005 . . . . 0.0 110.546 -176.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -46.49 -49.3 15.84 Favored Glycine 0 CA--C 1.529 0.957 0 C-N-CA 123.808 0.718 . . . . 0.0 111.717 176.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -93.62 117.98 67.4 Favored Pre-proline 0 CA--C 1.533 0.313 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 168.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.95 1.32 5.99 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.534 2.156 . . . . 0.0 114.57 -170.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -125.74 33.62 5.06 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.902 1.228 . . . . 0.0 110.8 174.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.401 ' N ' ' HB1' ' A' ' 14' ' ' ALA . 2.0 tt0 -145.74 149.91 35.27 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.434 0.693 . . . . 0.0 110.206 -176.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.5 mt -115.94 107.77 15.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.894 0.878 . . . . 0.0 109.949 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 5.6 t -72.82 166.15 23.49 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 120.113 1.324 . . . . 0.0 109.718 169.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -38.78 -45.75 1.18 Allowed 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 125.742 1.617 . . . . 0.0 112.168 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -59.48 -48.54 81.24 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.056 0.389 . . . . 0.0 111.401 177.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -69.97 -40.95 75.08 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 -177.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.24 -47.57 85.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.528 1.131 . . . . 0.0 108.993 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -59.2 -48.73 80.54 Favored 'General case' 0 N--CA 1.446 -0.652 0 O-C-N 121.123 -0.985 . . . . 0.0 110.573 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.8 tp -52.36 -58.66 5.99 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 121.965 -0.46 . . . . 0.0 110.954 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.261 1.2 pt? -71.8 -33.86 68.91 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 119.085 -1.046 . . . . 0.0 112.12 -175.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -65.05 -42.79 93.92 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.169 1.35 . . . . 0.0 110.325 177.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -56.27 -53.82 52.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 119.499 1.045 . . . . 0.0 110.695 170.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.7 m -64.28 -51.52 63.09 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 121.056 -0.258 . . . . 0.0 111.413 -170.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -81.33 -40.15 24.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.165 0.986 . . . . 0.0 111.526 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -129.69 64.73 72.86 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.213 1.005 . . . . 0.0 111.631 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -69.69 71.72 1.46 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 124.115 3.21 . . . . 0.0 112.144 -173.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 26.2 p -170.63 -73.55 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.829 0.852 . . . . 0.0 110.646 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.1 pp -51.91 -36.51 49.21 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.03 1.332 . . . . 0.0 114.479 -167.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.638 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.66 -30.24 68.61 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 177.344 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.528 ' N ' HD22 ' A' ' 40' ' ' LEU 0.343 19.2 ptpt 49.02 -56.75 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 129.296 3.039 . . . . 0.0 117.289 -173.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -162.73 162.33 34.45 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 120.135 1.334 . . . . 0.0 110.987 -176.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -56.91 -42.96 80.9 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.23 1.012 . . . . 0.0 111.644 -173.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.4 p -52.47 -59.27 4.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.792 0.837 . . . . 0.0 109.69 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.2 m -58.02 -38.16 75.68 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 119.017 -0.515 . . . . 0.0 111.429 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tt -58.87 -40.88 85.66 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 118.909 0.777 . . . . 0.0 109.379 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -56.96 -49.92 74.23 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 110.783 176.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.7 mm-40 -62.82 -55.09 29.45 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.331 0.586 . . . . 0.0 109.988 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.0 tp -48.95 -53.24 20.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.41 1.084 . . . . 0.0 109.361 177.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.36 -47.18 79.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.03 0.932 . . . . 0.0 110.659 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -55.96 -45.1 78.98 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.129 0.422 . . . . 0.0 110.922 176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.27 -41.52 80.95 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.168 0.587 . . . . 0.0 110.851 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.48 -56.56 7.04 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 127.251 2.22 . . . . 0.0 109.51 -174.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -80.63 51.0 1.4 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.674 1.59 . . . . 0.0 111.832 -169.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.4 mttp -50.32 -45.6 54.94 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.617 1.167 . . . . 0.0 113.049 -169.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -90.48 -48.39 7.13 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.184 0.594 . . . . 0.0 110.785 -176.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.4 -35.91 59.64 Favored Glycine 0 CA--C 1.527 0.83 0 CA-C-O 119.3 -0.722 . . . . 0.0 112.387 -171.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.6 t0 34.16 54.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.506 1.922 . . . . 0.0 112.851 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.67 -50.79 0.21 Allowed Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.471 -1.452 . . . . 0.0 109.471 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -137.44 132.13 32.95 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.068 0.947 . . . . 0.0 110.266 174.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.0 t -87.93 114.36 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 125.676 1.59 . . . . 0.0 109.167 -175.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.5 m -79.3 159.84 27.05 Favored 'General case' 0 C--N 1.335 -0.063 0 C-N-CA 123.823 0.849 . . . . 0.0 110.819 174.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -53.12 -33.79 53.86 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.478 0.656 . . . . 0.0 111.646 -179.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 28.4 mp0 -56.26 -47.35 78.75 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.006 0.922 . . . . 0.0 110.144 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -75.67 -36.08 60.19 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -58.45 -42.38 87.25 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.61 -0.681 . . . . 0.0 110.33 175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -57.15 -33.97 67.94 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.61 -1.306 . . . . 0.0 111.898 172.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 35.8 t -63.24 -45.73 97.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.402 1.001 . . . . 0.0 109.463 171.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.5 tp -51.3 -45.35 62.16 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.498 0.59 . . . . 0.0 110.42 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t -55.98 -38.35 52.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 118.845 0.748 . . . . 0.0 111.227 179.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 42.3 mmtm -58.67 -32.85 69.48 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.292 -0.88 . . . . 0.0 111.497 174.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -73.41 -55.81 5.88 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.7 -29.22 34.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 O-C-N 121.852 -0.53 . . . . 0.0 111.254 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.9 m 78.23 -46.88 0.44 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 127.103 2.161 . . . . 0.0 111.616 173.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? . . . . . 0 C--O 1.251 1.167 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.251 173.085 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? . . . . . 0 N--CA 1.474 0.775 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.98 -50.94 81.31 Favored Pre-proline 0 N--CA 1.452 -0.35 0 CA-C-O 118.179 -0.915 . . . . 0.0 113.09 -169.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_exo -52.2 -46.17 34.49 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 122.088 1.859 . . . . 0.0 111.861 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -67.02 -44.87 79.19 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.764 0.826 . . . . 0.0 110.031 -177.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -57.13 -50.88 71.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -65.27 -38.56 90.67 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.269 0.628 . . . . 0.0 110.106 -176.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -56.32 -54.51 44.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 170.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -51.9 -55.09 22.56 Favored Glycine 0 CA--C 1.529 0.908 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -49.46 -61.5 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.342 1.057 . . . . 0.0 109.521 175.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -45.16 -53.6 7.91 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.395 1.078 . . . . 0.0 110.654 178.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -60.85 -48.39 82.03 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.338 0.655 . . . . 0.0 110.539 -176.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.53 -44.72 93.12 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 117.893 0.315 . . . . 0.0 111.04 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -58.29 -62.48 1.8 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 117.758 0.254 . . . . 0.0 110.829 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.48 -52.24 6.22 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.154 1.382 . . . . 0.0 112.092 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -45.47 -32.98 2.43 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.932 1.293 . . . . 0.0 114.245 -177.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.7 ptpp? -66.42 -22.01 66.22 Favored 'General case' 0 C--N 1.344 0.369 0 CA-C-N 120.535 1.516 . . . . 0.0 111.525 -177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -87.84 19.68 3.41 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.204 1.002 . . . . 0.0 111.183 172.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.22 -61.87 3.78 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 110.631 -0.988 . . . . 0.0 110.631 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -61.37 115.22 13.58 Favored Pre-proline 0 CA--C 1.537 0.453 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -69.27 -22.91 33.65 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 121.957 1.771 . . . . 0.0 111.467 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -110.11 48.68 0.88 Allowed 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.917 0.887 . . . . 0.0 111.07 -176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.26 143.73 3.66 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 169.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -119.11 116.64 26.79 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.983 1.713 . . . . 0.0 109.978 175.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 95.7 p -63.11 169.52 3.38 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.024 -1.047 . . . . 0.0 110.204 169.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -45.73 -43.2 12.68 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.37 -0.832 . . . . 0.0 111.365 167.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.18 -47.69 73.14 Favored 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 122.226 -0.296 . . . . 0.0 110.412 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.94 -41.74 99.59 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.853 -0.529 . . . . 0.0 109.977 179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -60.5 -49.74 76.35 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.571 1.548 . . . . 0.0 110.129 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.5 pttm -62.38 -40.77 97.55 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 119.295 -0.962 . . . . 0.0 110.121 175.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -56.9 -57.2 13.55 Favored 'General case' 0 C--O 1.234 0.273 0 O-C-N 121.531 -0.731 . . . . 0.0 111.098 -178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.269 1.4 pt? -69.4 -35.79 76.12 Favored 'General case' 0 C--O 1.227 -0.12 0 C-N-CA 119.229 -0.988 . . . . 0.0 112.113 -176.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -64.86 -40.73 95.6 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 119.453 1.024 . . . . 0.0 110.676 176.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -57.21 -52.19 66.33 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 119.468 1.031 . . . . 0.0 110.954 170.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -61.25 -56.05 25.02 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.016 0.436 . . . . 0.0 110.698 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -83.31 -36.6 24.32 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.502 1.121 . . . . 0.0 111.799 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -130.05 60.95 55.54 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 123.678 0.791 . . . . 0.0 112.247 -172.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -66.23 75.55 0.35 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 124.576 3.518 . . . . 0.0 111.934 -174.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.6 m 173.59 -42.93 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 129.068 2.947 . . . . 0.0 108.684 -176.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.1 mt -82.55 50.6 1.68 Allowed 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.216 -0.927 . . . . 0.0 111.639 -171.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -169.33 40.66 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.968 1.307 . . . . 0.0 110.985 -178.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -70.25 77.3 0.53 Allowed 'General case' 0 CA--C 1.537 0.478 0 O-C-N 121.479 -0.763 . . . . 0.0 113.0 -169.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 132.04 129.3 3.01 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 124.958 1.266 . . . . 0.0 111.453 169.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 44.2 tpp -56.94 -37.03 70.94 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.002 0.521 . . . . 0.0 109.83 173.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.8 p -59.59 -64.53 0.91 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.24 1.016 . . . . 0.0 109.101 169.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -44.05 -35.78 2.26 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 126.419 1.888 . . . . 0.0 113.146 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp -49.34 -42.79 42.79 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.419 0.687 . . . . 0.0 110.134 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -55.23 -50.67 68.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.597 0.359 . . . . 0.0 110.414 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 28.3 mp0 -66.69 -50.24 63.52 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.3 tt -50.57 -57.98 6.89 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -52.65 -50.73 62.6 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.258 1.023 . . . . 0.0 110.928 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -54.53 -42.44 70.89 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.848 0.749 . . . . 0.0 111.611 179.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -72.04 -20.04 61.74 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.52 0.328 . . . . 0.0 111.607 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -90.75 -58.59 2.43 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.922 1.289 . . . . 0.0 110.206 -176.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -78.81 43.32 0.49 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.513 1.925 . . . . 0.0 113.311 -167.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt -79.89 58.1 2.78 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.178 0.991 . . . . 0.0 111.852 -169.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 177.43 -54.06 0.01 OUTLIER 'General case' 0 CA--C 1.527 0.088 0 C-N-CA 127.182 2.193 . . . . 0.0 107.934 175.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -68.85 -34.41 77.34 Favored Glycine 0 CA--C 1.528 0.865 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.8 t70 68.64 -59.7 0.45 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 126.721 2.008 . . . . 0.0 113.243 175.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.2 -37.32 6.73 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.58 1.086 . . . . 0.0 112.295 -178.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -138.11 138.49 38.75 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.778 0.831 . . . . 0.0 110.222 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 43.7 t -88.72 116.61 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.106 0 C-N-CA 127.106 2.162 . . . . 0.0 109.826 -172.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.9 p -70.13 168.32 15.88 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.742 0.817 . . . . 0.0 111.471 173.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -60.92 -35.56 77.01 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-O 121.596 0.713 . . . . 0.0 109.676 169.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -58.9 -51.99 67.65 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.005 0.922 . . . . 0.0 109.094 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -65.98 -40.18 91.01 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.359 0.599 . . . . 0.0 110.247 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -60.4 -34.0 73.29 Favored 'General case' 0 C--O 1.216 -0.697 0 O-C-N 121.375 -0.828 . . . . 0.0 111.479 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.6 -35.06 73.58 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.03 -1.669 . . . . 0.0 111.703 170.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.5 t -62.75 -42.39 96.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 O-C-N 121.038 -1.039 . . . . 0.0 108.739 169.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -53.51 -43.49 68.34 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.403 169.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.418 ' HA ' HG12 ' A' ' 73' ' ' ILE . 61.6 t -55.88 -45.14 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-N 120.139 1.336 . . . . 0.0 110.289 177.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -56.7 -50.55 71.83 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.997 -0.439 . . . . 0.0 110.165 173.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -58.47 -47.92 82.45 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.418 HG12 ' HA ' ' A' ' 70' ' ' VAL . 30.3 pt -64.57 -28.61 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.489 -0.757 . . . . 0.0 110.868 176.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 68.9 m 57.93 46.0 17.34 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.542 1.137 . . . . 0.0 111.443 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 . . . . . 0 C--O 1.251 1.155 0 CA-C-O 117.723 -1.132 . . . . 0.0 109.312 -178.901 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.61 -50.08 61.43 Favored Pre-proline 0 N--CA 1.451 -0.395 0 C-N-CA 124.05 0.94 . . . . 0.0 113.221 -170.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -48.68 -47.81 19.65 Favored 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 121.783 1.656 . . . . 0.0 112.323 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -69.62 -43.33 72.91 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 122.862 0.465 . . . . 0.0 110.332 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -54.69 -54.46 41.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.086 0.47 . . . . 0.0 109.775 177.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -68.07 -34.46 76.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.621 -177.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -57.78 -50.12 74.31 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 119.67 1.123 . . . . 0.0 110.558 172.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.23 -53.84 41.67 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 23.4 mt -49.45 -62.27 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 173.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -45.99 -57.18 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.007 1.323 . . . . 0.0 111.165 -177.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -66.13 -36.2 82.52 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 119.326 -0.369 . . . . 0.0 111.215 -174.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.3 mmtm -63.5 -49.21 74.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.672 0.669 . . . . 0.0 110.005 176.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -57.8 -52.65 64.58 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.717 -0.615 . . . . 0.0 111.363 177.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.61 -57.74 3.95 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 123.031 0.532 . . . . 0.0 110.626 172.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.45 -34.42 64.47 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.23 0.612 . . . . 0.0 112.626 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -66.84 -35.89 81.08 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.188 0.904 . . . . 0.0 110.155 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.6 tt0 -64.18 -50.48 67.95 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 149.27 -49.0 0.58 Allowed Glycine 0 CA--C 1.525 0.685 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -60.37 129.94 89.39 Favored Pre-proline 0 CA--C 1.534 0.356 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -66.98 -13.76 41.12 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.094 1.863 . . . . 0.0 114.03 -173.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -159.83 38.79 0.19 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.697 1.135 . . . . 0.0 113.569 -176.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -152.06 135.31 15.88 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.855 -0.528 . . . . 0.0 111.128 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.6 mt -109.2 108.93 19.74 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.809 1.244 . . . . 0.0 110.532 -173.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.4 t -70.79 165.8 22.35 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 119.43 1.014 . . . . 0.0 110.698 169.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 59.3 mtmt -38.24 -51.22 1.47 Allowed 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 126.222 1.809 . . . . 0.0 112.378 -176.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.0 mp0 -65.41 -39.44 92.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 119.77 -0.157 . . . . 0.0 110.709 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.74 -42.0 74.51 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.5 tp -58.53 -48.68 80.06 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 110.574 -0.158 . . . . 0.0 110.574 175.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.85 -52.17 66.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.301 -0.874 . . . . 0.0 109.433 177.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.7 tp -51.28 -60.34 3.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 123.349 0.406 . . . . 0.0 110.363 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.281 0.9 OUTLIER -69.94 -32.33 70.54 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 119.126 -1.03 . . . . 0.0 112.467 -173.435 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.1 mp -65.81 -44.95 84.1 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 119.962 1.255 . . . . 0.0 110.48 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -48.53 80.46 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 117.99 0.359 . . . . 0.0 110.289 176.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -64.81 -53.47 46.4 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 120.428 0.156 . . . . 0.0 110.695 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -83.8 -41.21 17.8 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.237 0.615 . . . . 0.0 111.432 -171.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -121.17 56.78 5.94 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.55 0.614 . . . . 0.0 111.962 -174.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -64.48 149.7 89.54 Favored 'Trans proline' 0 N--CA 1.451 -0.986 0 C-N-CA 122.13 1.887 . . . . 0.0 110.05 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.9 t 75.18 -40.08 0.42 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.562 1.545 . . . . 0.0 112.565 174.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 61.0 tp -51.22 -38.38 52.13 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.415 0.552 . . . . 0.0 109.575 170.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.33 166.46 17.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.088 0.955 . . . . 0.0 109.77 168.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -131.62 76.22 1.7 Allowed 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 172.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -77.75 55.47 3.81 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.145 0.878 . . . . 0.0 113.365 -169.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -87.61 -122.86 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.631 -1.618 . . . . 0.0 106.631 168.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -47.45 -42.05 21.67 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.073 0.949 . . . . 0.0 111.268 173.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -44.32 -33.96 1.79 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.868 2.067 . . . . 0.0 113.089 175.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.0 tp -51.03 -39.61 56.29 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.446 0.698 . . . . 0.0 109.759 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -54.36 -53.55 52.44 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 118.258 0.481 . . . . 0.0 110.562 179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -67.17 -49.6 64.12 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -176.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 52.4 tp -55.61 -52.68 62.96 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 19.1 t80 -57.78 -44.71 86.4 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.533 0.733 . . . . 0.0 110.419 178.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.35 -41.07 88.37 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.069 0.395 . . . . 0.0 111.149 178.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -68.85 -46.6 68.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.671 0.748 . . . . 0.0 109.272 -178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.77 -54.77 8.0 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.324 1.45 . . . . 0.0 110.672 -170.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -80.55 48.23 1.03 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.514 1.126 . . . . 0.0 112.886 -168.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -48.51 -48.29 38.29 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 125.429 1.491 . . . . 0.0 112.694 -169.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.15 -45.63 6.79 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.704 0.802 . . . . 0.0 110.702 -176.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -79.88 -7.08 88.81 Favored Glycine 0 CA--C 1.53 1.005 0 CA-C-O 118.166 -1.352 . . . . 0.0 113.527 -170.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.2 t0 0.34 75.1 0.0 OUTLIER 'General case' 0 C--N 1.347 0.479 0 C-N-CA 129.152 2.981 . . . . 0.0 114.261 176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.04 -46.09 0.68 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 108.431 -1.867 . . . . 0.0 108.431 -169.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -151.77 135.72 16.49 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 112.11 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 54.2 t -88.08 116.13 29.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 C-N-CA 127.269 2.228 . . . . 0.0 110.335 -168.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 89.4 p -67.59 164.69 18.54 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.151 0.98 . . . . 0.0 111.075 175.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -58.92 -37.67 77.19 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.22 0.533 . . . . 0.0 110.368 170.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -56.52 -54.82 41.41 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.193 0.597 . . . . 0.0 110.26 175.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -61.49 -43.43 98.88 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.035 0.445 . . . . 0.0 110.013 178.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -56.49 -41.74 77.15 Favored 'General case' 0 C--O 1.224 -0.286 0 O-C-N 122.058 -0.401 . . . . 0.0 111.002 -179.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -58.31 -27.6 64.24 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.119 -0.988 . . . . 0.0 112.345 176.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.72 -43.02 97.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.633 1.106 . . . . 0.0 109.497 170.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -58.99 -46.75 87.39 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.689 -0.632 . . . . 0.0 109.317 172.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -54.93 -41.86 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 O-C-N 120.998 -1.064 . . . . 0.0 111.176 175.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -56.97 -32.76 66.38 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.647 -0.658 . . . . 0.0 111.013 175.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.0 -52.55 14.0 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.464 0.574 . . . . 0.0 110.35 172.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.3 -34.08 45.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 118.878 0.763 . . . . 0.0 111.712 -175.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.8 m 67.3 36.6 3.89 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 125.238 1.415 . . . . 0.0 112.148 172.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.725 -1.131 . . . . 0.0 108.903 171.631 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? . . . . . 0 N--CA 1.474 0.743 0 CA-C-O 120.675 0.274 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -58.01 22.78 Favored Pre-proline 0 N--CA 1.448 -0.564 0 CA-C-O 118.35 -0.833 . . . . 0.0 112.642 -177.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -56.59 -37.33 97.76 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 CA-C-N 120.881 1.35 . . . . 0.0 111.241 179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -64.86 -51.54 61.46 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 122.654 0.381 . . . . 0.0 110.904 178.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -65.66 -38.89 90.59 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.451 -0.781 . . . . 0.0 109.11 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.13 -30.73 71.28 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 118.154 -0.927 . . . . 0.0 111.254 174.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -59.32 -46.51 88.38 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 120.346 1.43 . . . . 0.0 109.321 169.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.97 -56.8 16.94 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 175.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 33.5 mt -50.02 -63.18 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 123.391 0.676 . . . . 0.0 109.637 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -43.01 -52.79 5.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 126.423 1.889 . . . . 0.0 110.675 179.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -59.4 -50.57 73.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.221 1.009 . . . . 0.0 110.376 -178.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -60.57 -40.39 91.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.126 -0.359 . . . . 0.0 111.449 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -61.55 -60.8 3.15 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 118.321 0.509 . . . . 0.0 111.811 171.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.47 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -40.77 -53.8 2.77 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 124.924 1.29 . . . . 0.0 111.613 177.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.05 -28.9 4.42 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.682 1.193 . . . . 0.0 113.673 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -60.36 -29.34 68.85 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 119.229 0.922 . . . . 0.0 111.012 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -88.07 14.8 8.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.087 0.955 . . . . 0.0 112.014 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.45 -54.71 3.66 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 121.069 -1.02 . . . . 0.0 111.021 -175.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -49.46 119.53 9.4 Favored Pre-proline 0 CA--C 1.535 0.382 0 C-N-CA 123.834 0.854 . . . . 0.0 109.5 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -71.83 -20.64 25.8 Favored 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.024 1.816 . . . . 0.0 112.547 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -148.76 53.74 0.99 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.91 0.777 . . . . 0.0 110.977 -168.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.47 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 1.2 tt0 -161.42 141.15 10.43 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 121.725 -0.61 . . . . 0.0 111.611 171.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 73.4 mt -115.48 108.12 16.06 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.107 1.363 . . . . 0.0 110.311 -178.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.6 m -63.63 159.5 18.84 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.166 -0.959 . . . . 0.0 109.749 168.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -39.18 -46.83 1.53 Allowed 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 124.616 1.166 . . . . 0.0 113.071 176.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -61.09 -43.95 98.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 117.761 0.255 . . . . 0.0 111.389 178.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -68.69 -42.42 77.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -59.46 -47.34 85.86 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 177.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.9 ttmt -56.79 -50.28 72.81 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.484 -0.76 . . . . 0.0 109.709 175.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -53.03 -57.34 10.71 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 122.656 0.382 . . . . 0.0 111.627 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.0 OUTLIER -73.44 -33.63 65.02 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 119.286 0.948 . . . . 0.0 112.472 -176.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.18 -38.74 92.37 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 120.691 1.587 . . . . 0.0 109.387 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.24 -50.8 71.59 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.956 -0.465 . . . . 0.0 111.413 171.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.3 m -68.57 -47.68 66.19 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.19 -0.604 . . . . 0.0 109.788 -171.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -88.65 -39.52 13.98 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.334 1.053 . . . . 0.0 111.466 -170.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -127.39 58.52 31.52 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.742 0.701 . . . . 0.0 112.689 -171.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -69.31 72.15 1.24 Allowed 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 124.534 3.489 . . . . 0.0 111.661 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.1 m -178.84 -35.69 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 128.709 2.804 . . . . 0.0 109.515 -178.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 39.2 tp -68.46 -42.08 79.26 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 121.801 0.81 . . . . 0.0 110.198 -170.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.59 64.63 0.11 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.61 1.964 . . . . 0.0 112.285 178.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -65.62 77.66 0.07 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 111.678 -177.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.56 133.55 8.06 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -174.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 66.6 mtt -61.78 -55.11 33.58 Favored 'General case' 0 N--CA 1.455 -0.183 0 O-C-N 122.423 -0.457 . . . . 0.0 109.922 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -48.1 -46.14 33.58 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.0 1.32 . . . . 0.0 111.255 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -49.51 -26.81 3.72 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.788 1.635 . . . . 0.0 112.821 179.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.29 -34.3 68.55 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-O 118.954 -0.546 . . . . 0.0 110.438 177.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -55.28 -54.39 44.09 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.279 0.945 . . . . 0.0 110.505 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mp0 -65.8 -50.81 63.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.41 0.684 . . . . 0.0 109.708 -177.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.7 tp -51.96 -55.59 19.44 Favored 'General case' 0 C--O 1.225 -0.215 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -53.45 -49.07 68.17 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.119 1.368 . . . . 0.0 110.728 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -53.89 -43.3 69.54 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 117.735 0.243 . . . . 0.0 111.282 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -76.09 -43.42 43.5 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 111.277 -179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 tt -55.48 -56.15 23.58 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.776 1.63 . . . . 0.0 109.435 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -80.24 45.8 0.78 Allowed 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.098 1.359 . . . . 0.0 113.209 -168.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -77.92 60.67 2.37 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 122.029 0.919 . . . . 0.0 111.137 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -172.26 -55.0 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 126.383 1.873 . . . . 0.0 108.102 174.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -81.05 -35.33 24.49 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 41.01 50.43 3.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.251 1.82 . . . . 0.0 112.1 178.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 168.96 -45.51 0.22 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.312 -1.115 . . . . 0.0 110.312 -174.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -135.17 133.01 38.69 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.74 1.216 . . . . 0.0 108.448 173.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 29.4 t -86.88 112.33 22.88 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.054 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.8 p -78.67 162.19 26.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 123.547 0.739 . . . . 0.0 109.857 172.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -54.7 -31.61 58.27 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.311 0.577 . . . . 0.0 111.233 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -51.43 -55.97 15.82 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.819 0.848 . . . . 0.0 110.543 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -72.98 -35.18 66.84 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 -176.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -56.85 -42.82 80.39 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.698 -0.626 . . . . 0.0 110.663 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -57.07 -34.43 68.27 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.072 -1.017 . . . . 0.0 111.812 174.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.2 t -61.38 -42.83 95.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.432 1.014 . . . . 0.0 109.386 172.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.5 -45.99 80.75 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.673 -0.642 . . . . 0.0 109.882 171.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.07 -41.2 67.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 O-C-N 121.097 -1.002 . . . . 0.0 111.378 175.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -58.27 -26.11 62.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.422 -0.798 . . . . 0.0 111.696 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 28.5 mmmt -77.34 -53.74 7.32 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.853 0.752 . . . . 0.0 110.045 170.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.85 -35.97 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-N 118.572 0.624 . . . . 0.0 111.657 -174.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.7 m 63.63 43.44 5.73 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.885 1.274 . . . . 0.0 111.984 173.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 . . . . . 0 C--O 1.253 1.272 0 CA-C-O 117.293 -1.337 . . . . 0.0 109.835 177.538 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.7 tttt . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.769 -0.086 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -47.84 -47.29 63.11 Favored Pre-proline 0 N--CA 1.453 -0.293 0 CA-C-O 117.663 -1.161 . . . . 0.0 113.895 -171.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -50.13 -52.76 8.3 Favored 'Trans proline' 0 N--CA 1.455 -0.743 0 C-N-CA 121.914 1.743 . . . . 0.0 112.385 176.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -73.58 -39.39 64.69 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.591 0.356 . . . . 0.0 110.606 -175.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.78 -54.4 44.89 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.448 ' CD2' HD11 ' A' ' 73' ' ' ILE . 9.2 mp -71.54 -28.04 63.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 118.549 -0.739 . . . . 0.0 110.86 -175.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -57.9 -51.2 70.61 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.437 1.017 . . . . 0.0 108.781 168.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.47 -54.84 27.89 Favored Glycine 0 CA--C 1.529 0.921 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 176.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 47.7 mt -50.02 -61.27 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.849 0.859 . . . . 0.0 109.789 176.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -45.88 -54.54 8.0 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 125.24 1.416 . . . . 0.0 110.244 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.95 -43.71 98.27 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -64.76 -43.16 94.2 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.614 1.097 . . . . 0.0 111.638 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -55.8 -57.36 12.35 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-N 119.299 0.954 . . . . 0.0 111.098 171.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.72 -51.26 7.28 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 124.322 1.049 . . . . 0.0 111.883 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.74 -29.82 29.17 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -32.06 71.57 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.615 1.098 . . . . 0.0 110.505 174.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -87.91 21.44 2.68 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.35 1.46 . . . . 0.0 110.777 173.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.22 -62.23 3.4 Favored Glycine 0 CA--C 1.528 0.854 0 O-C-N 120.792 -1.192 . . . . 0.0 111.575 178.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -59.03 122.92 66.52 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 117.39 0.595 . . . . 0.0 109.671 -177.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.88 -10.31 24.65 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.188 1.925 . . . . 0.0 113.576 -172.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -143.59 42.08 1.47 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 119.541 1.064 . . . . 0.0 112.012 -176.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.485 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 46.1 tt0 -152.08 139.44 19.46 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.287 -0.883 . . . . 0.0 111.42 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 65.8 mt -119.57 131.99 55.64 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.814 1.246 . . . . 0.0 110.099 177.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 57.4 p -72.92 172.6 10.62 Favored 'General case' 0 C--O 1.224 -0.277 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 167.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -57.03 -33.26 67.01 Favored 'General case' 0 C--O 1.226 -0.138 0 O-C-N 121.072 -1.018 . . . . 0.0 112.26 168.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.8 mp0 -65.16 -53.33 46.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.458 0.572 . . . . 0.0 110.134 174.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -61.6 -39.85 92.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 5.0 tp -59.75 -47.69 84.65 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.349 0.659 . . . . 0.0 110.263 175.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -55.57 -48.45 74.78 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.305 -0.872 . . . . 0.0 109.679 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.31 -66.62 0.37 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.578 0.751 . . . . 0.0 110.065 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.265 1.2 pt? -70.21 -29.94 66.91 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.573 -172.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mp -66.75 -44.5 81.3 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 120.516 1.507 . . . . 0.0 110.581 177.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.54 -49.39 76.89 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.311 0.505 . . . . 0.0 110.262 174.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.3 m -65.97 -50.89 62.74 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.171 -173.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -84.41 -40.67 17.52 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.843 0.857 . . . . 0.0 111.657 -173.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -121.32 61.26 10.72 Favored Pre-proline 0 CA--C 1.542 0.653 0 CA-C-O 117.986 -1.007 . . . . 0.0 111.594 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 0.6 OUTLIER -22.04 79.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.774 1 C-N-CA 127.685 5.59 . . . . 0.0 117.61 -175.543 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 30.5 m 47.86 33.85 3.56 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.893 1.277 . . . . 0.0 112.849 178.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.16 -43.38 64.07 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.496 1.118 . . . . 0.0 108.987 171.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.774 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -95.82 22.21 7.59 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 126.035 1.734 . . . . 0.0 111.694 178.628 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.1 mppt? 68.06 -54.67 0.51 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 127.373 2.269 . . . . 0.0 112.749 178.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 76.63 -61.44 3.24 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 74.8 mtm -47.46 112.01 0.49 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.515 1.126 . . . . 0.0 109.781 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 16.6 m 64.68 -61.96 0.2 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 126.832 2.053 . . . . 0.0 111.888 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 m -37.05 -33.97 0.07 Allowed 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 129.321 3.048 . . . . 0.0 114.342 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.8 tp -48.17 -41.0 25.77 Favored 'General case' 0 C--O 1.221 -0.428 0 C-N-CA 123.544 0.738 . . . . 0.0 110.246 176.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -51.55 -58.93 4.94 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.148 0.499 . . . . 0.0 110.41 177.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.94 -49.99 70.4 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.965 0.506 . . . . 0.0 109.737 -175.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -51.57 -55.0 21.66 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.763 0.825 . . . . 0.0 108.906 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.436 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 17.2 t80 -56.58 -47.39 79.65 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.645 0.778 . . . . 0.0 110.992 178.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.42 -40.31 86.29 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 118.543 0.61 . . . . 0.0 111.284 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 68.0 tt0 -68.91 -45.99 69.46 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.688 0.756 . . . . 0.0 109.269 -177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.54 -51.51 55.8 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.554 1.542 . . . . 0.0 110.591 -175.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -74.49 72.35 1.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.725 1.21 . . . . 0.0 109.548 -174.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -52.15 -36.49 51.62 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.156 1.382 . . . . 0.0 111.506 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.19 -20.01 63.98 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.79 34.11 81.02 Favored Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -171.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -85.15 -4.2 59.07 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.947 0.499 . . . . 0.0 111.927 -174.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 71.18 16.21 75.03 Favored Glycine 0 CA--C 1.531 1.088 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 -169.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -154.14 155.72 35.87 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.948 1.699 . . . . 0.0 107.326 -169.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.8 t -125.2 113.37 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.063 1.345 . . . . 0.0 109.016 -175.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.2 p -69.93 168.09 16.05 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 124.339 1.056 . . . . 0.0 110.857 170.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -56.49 -42.02 77.59 Favored 'General case' 0 C--N 1.342 0.246 0 O-C-N 121.865 -0.522 . . . . 0.0 109.961 169.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 22.1 mp0 -58.89 -49.44 77.77 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.23 0.612 . . . . 0.0 109.585 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -61.36 -45.99 92.08 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.195 175.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -52.98 -40.55 63.83 Favored 'General case' 0 C--O 1.225 -0.193 0 O-C-N 122.05 -0.406 . . . . 0.0 111.094 178.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -55.39 -31.87 62.18 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.212 -0.93 . . . . 0.0 111.844 176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.8 t -64.2 -35.11 72.9 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.473 -0.767 . . . . 0.0 110.168 173.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.6 tp -66.36 -45.21 80.89 Favored 'General case' 0 CA--C 1.53 0.178 0 O-C-N 121.475 -0.765 . . . . 0.0 109.143 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.9 t -54.02 -41.3 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 118.086 0.403 . . . . 0.0 110.813 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -53.47 -34.58 58.48 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.513 -0.742 . . . . 0.0 112.34 172.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -76.45 -52.64 9.44 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 118.719 0.691 . . . . 0.0 110.684 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.448 HD11 ' CD2' ' A' ' 6' ' ' LEU . 0.8 OUTLIER -59.93 -35.19 59.29 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 CA-C-O 121.092 0.472 . . . . 0.0 110.974 -177.006 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 t 69.55 -66.25 0.27 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 127.115 2.166 . . . . 0.0 111.229 -173.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 116.413 -1.755 . . . . 0.0 109.798 -168.686 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 111.337 0.125 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -48.23 -56.41 14.25 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-O 118.383 -0.818 . . . . 0.0 111.636 -179.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_exo -44.64 -40.28 13.93 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.838 2.359 . . . . 0.0 114.163 171.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 77.8 tt0 -71.66 -41.26 68.95 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 118.178 0.444 . . . . 0.0 109.823 -179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -56.57 -51.3 69.11 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 172.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -60.08 -39.3 85.61 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 119.001 -0.523 . . . . 0.0 110.661 177.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -57.48 -51.81 67.94 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 119.009 0.822 . . . . 0.0 110.443 174.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.12 -54.56 30.92 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.851 -0.899 . . . . 0.0 110.851 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.2 mt -49.78 -63.07 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -43.45 -57.24 3.17 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.149 1.38 . . . . 0.0 111.007 -179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.48 -36.66 81.57 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.388 -0.525 . . . . 0.0 110.767 -174.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -62.08 -47.54 84.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.26 0.482 . . . . 0.0 110.786 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -58.43 -55.45 34.89 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 118.594 0.634 . . . . 0.0 111.008 175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -54.26 7.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.617 0.767 . . . . 0.0 111.515 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.52 -28.88 9.3 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 178.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.44 -33.35 69.61 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 119.951 1.251 . . . . 0.0 111.107 178.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -102.81 29.25 5.5 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.149 0.58 . . . . 0.0 110.522 175.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.18 -47.82 3.24 Favored Glycine 0 CA--C 1.53 0.977 0 O-C-N 121.12 -0.988 . . . . 0.0 112.421 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -39.69 115.18 1.03 Allowed Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 124.961 1.304 . . . . 0.0 111.734 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -69.97 -35.82 11.33 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 121.603 1.535 . . . . 0.0 110.326 178.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -137.34 68.91 1.41 Allowed 'General case' 0 C--O 1.233 0.236 0 C-N-CA 123.825 0.85 . . . . 0.0 109.733 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -173.75 142.96 0.95 Allowed 'General case' 0 C--N 1.343 0.315 0 N-CA-C 115.783 1.771 . . . . 0.0 115.783 169.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.1 mt -117.24 109.03 16.37 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.41 1.484 . . . . 0.0 111.045 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.1 m -59.75 156.06 14.73 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.856 0.753 . . . . 0.0 109.1 167.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -45.87 -39.89 9.22 Favored 'General case' 0 C--O 1.224 -0.271 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -72.96 -34.02 66.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 119.02 0.827 . . . . 0.0 111.529 177.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -63.88 -49.23 73.52 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 174.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.72 -48.67 77.24 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.888 -0.507 . . . . 0.0 109.928 173.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -53.59 -57.67 9.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.133 0.424 . . . . 0.0 110.716 -177.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -71.26 -33.56 69.91 Favored 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -168.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.557 HD23 ' C ' ' A' ' 31' ' ' LEU . 3.5 tt -56.64 -59.09 5.51 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 107.675 -1.231 . . . . 0.0 107.675 169.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.2 mp -54.66 -42.93 71.92 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 121.413 -0.805 . . . . 0.0 111.538 -178.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -62.4 -49.7 74.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 118.432 0.56 . . . . 0.0 110.115 -179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 37.0 m -69.51 -48.94 58.91 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.932 0.396 . . . . 0.0 110.023 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -81.85 -41.23 21.31 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 118.318 -0.849 . . . . 0.0 111.742 -169.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -112.4 73.86 1.45 Allowed Pre-proline 0 CA--C 1.541 0.63 0 CA-C-N 119.273 0.942 . . . . 0.0 112.018 -170.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -61.17 158.71 33.57 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.47 2.113 . . . . 0.0 109.537 172.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 12.5 m 66.79 -41.12 0.39 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.402 1.481 . . . . 0.0 113.973 -169.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.0 mp -76.5 -40.36 50.37 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 119.21 0.914 . . . . 0.0 109.63 -172.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.39 9.56 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 117.575 2.435 . . . . 0.0 117.575 178.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -79.4 65.52 4.59 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 119.979 1.263 . . . . 0.0 109.749 -170.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 177.31 65.39 0.06 OUTLIER Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -175.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -67.53 -57.93 5.62 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 122.852 0.461 . . . . 0.0 109.959 -173.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.9 p -54.64 -44.6 73.35 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 121.659 0.742 . . . . 0.0 109.79 171.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.51 -13.19 0.87 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 125.663 1.585 . . . . 0.0 113.188 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 20.1 tp -48.61 -40.04 26.12 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 119.426 1.012 . . . . 0.0 109.379 169.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -54.17 -53.44 53.39 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.983 0.42 . . . . 0.0 110.6 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -63.95 -53.59 47.76 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 55.9 tp -51.67 -55.79 17.44 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.023 0.529 . . . . 0.0 109.714 -178.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.466 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 16.9 t80 -55.66 -47.86 75.99 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.835 0.854 . . . . 0.0 110.754 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -56.42 -39.99 73.97 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.025 0.375 . . . . 0.0 111.932 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -76.58 -49.07 17.26 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 109.937 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.2 tt -62.26 -56.81 14.88 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 125.932 1.693 . . . . 0.0 109.615 -174.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -80.87 43.61 0.7 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.965 0.906 . . . . 0.0 112.293 -169.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -61.99 -32.98 73.5 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -168.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -89.13 -47.52 8.03 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 122.802 0.441 . . . . 0.0 110.698 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -72.97 -39.23 54.88 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-O 119.604 -0.553 . . . . 0.0 111.866 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 t0 42.52 53.21 4.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.364 1.466 . . . . 0.0 112.136 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.74 -55.22 0.2 Allowed Glycine 0 CA--C 1.524 0.602 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -134.64 141.1 46.49 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.038 0.935 . . . . 0.0 109.548 173.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.407 HG23 ' CE1' ' A' ' 50' ' ' PHE . 35.5 t -88.55 120.36 37.26 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 C-N-CA 125.209 1.404 . . . . 0.0 109.529 -176.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -71.86 163.47 27.77 Favored 'General case' 0 N--CA 1.461 0.078 0 C-N-CA 123.946 0.898 . . . . 0.0 111.107 172.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -58.52 -35.13 71.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.861 0.838 . . . . 0.0 109.876 170.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -60.77 -51.68 68.3 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.439 1.096 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -63.36 -44.5 94.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 120.95 0.405 . . . . 0.0 110.123 174.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -53.96 -44.3 70.62 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 123.399 0.68 . . . . 0.0 110.889 -177.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -55.03 -31.3 60.97 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.34 -0.85 . . . . 0.0 112.396 176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.57 -37.8 79.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 119.013 0.824 . . . . 0.0 110.262 172.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.2 tp -63.37 -50.27 70.59 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 56.2 t -53.51 -42.91 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 117.86 0.3 . . . . 0.0 111.071 -177.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.5 tttm -51.89 -34.57 41.87 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.197 0.599 . . . . 0.0 111.58 176.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -82.09 -49.8 9.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.984 0.514 . . . . 0.0 110.591 175.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -35.58 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-N 119.101 0.864 . . . . 0.0 111.25 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m 73.06 -57.92 0.62 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 126.945 2.098 . . . . 0.0 112.139 173.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.145 -1.407 . . . . 0.0 111.825 178.57 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.4 tptm . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 121.727 0.775 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.3 -53.13 18.78 Favored Pre-proline 0 CA--C 1.533 0.3 0 C-N-CA 125.713 1.605 . . . . 0.0 112.685 -174.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -49.67 -49.62 15.35 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.367 2.045 . . . . 0.0 112.786 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -69.05 -39.24 79.29 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 122.497 0.319 . . . . 0.0 110.585 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -56.86 -52.29 65.7 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 174.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 23.3 mt -63.75 -39.58 94.63 Favored 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 124.283 1.033 . . . . 0.0 110.569 -178.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -58.15 -52.86 63.8 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.243 0.617 . . . . 0.0 110.4 172.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.3 -55.14 28.06 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.754 -0.938 . . . . 0.0 110.754 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 18.4 mt -43.62 -64.83 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 125.028 1.331 . . . . 0.0 109.455 171.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -45.59 -53.29 9.34 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.61 1.164 . . . . 0.0 110.7 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -59.51 -48.61 80.97 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 122.903 0.481 . . . . 0.0 110.977 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -59.96 -43.45 95.04 Favored 'General case' 0 CA--C 1.528 0.13 0 O-C-N 122.004 -0.435 . . . . 0.0 111.167 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -62.02 -58.44 7.84 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 118.003 0.365 . . . . 0.0 111.081 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.444 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.17 -53.07 5.24 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.102 0.961 . . . . 0.0 111.928 177.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.8 -27.9 8.23 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.376 1.071 . . . . 0.0 113.646 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -60.93 -28.72 69.15 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.555 1.071 . . . . 0.0 110.809 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -93.08 21.06 6.13 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.37 1.068 . . . . 0.0 111.284 174.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.31 -59.31 3.64 Favored Glycine 0 CA--C 1.528 0.854 0 O-C-N 121.327 -0.858 . . . . 0.0 111.291 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -55.03 116.98 12.67 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 123.544 0.737 . . . . 0.0 109.573 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -70.82 -19.95 30.42 Favored 'Trans proline' 0 N--CA 1.453 -0.873 0 C-N-CA 121.995 1.797 . . . . 0.0 112.115 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -129.4 58.19 1.63 Allowed 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.295 0.638 . . . . 0.0 111.914 -176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.444 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -171.69 140.2 1.3 Allowed 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 167.608 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 77.4 mt -112.02 119.04 37.12 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.814 1.646 . . . . 0.0 109.622 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 88.9 p -61.91 169.19 2.71 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 119.834 1.197 . . . . 0.0 109.752 168.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -52.24 -36.96 53.87 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.004 -1.06 . . . . 0.0 111.875 168.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -65.24 -51.06 63.25 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 177.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -61.16 -41.94 97.67 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -61.48 -48.63 80.25 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.867 1.267 . . . . 0.0 109.605 178.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.2 tttp -58.38 -51.16 70.99 Favored 'General case' 0 N--CA 1.452 -0.347 0 O-C-N 121.281 -0.887 . . . . 0.0 110.341 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -49.03 -61.99 1.77 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.339 1.055 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.277 1.0 OUTLIER -68.09 -32.73 73.25 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 119.073 -1.051 . . . . 0.0 112.322 -175.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.1 mp -63.39 -46.77 84.9 Favored 'General case' 0 C--N 1.34 0.153 0 CA-C-N 119.925 1.238 . . . . 0.0 110.449 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -56.09 -52.37 64.55 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.025 173.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.0 m -66.52 -47.97 71.23 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.039 -170.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -87.56 -41.55 13.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.576 0.75 . . . . 0.0 111.981 -172.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -114.57 84.0 9.45 Favored Pre-proline 0 C--O 1.233 0.236 0 CA-C-N 118.67 0.668 . . . . 0.0 110.671 -169.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -60.13 166.0 9.72 Favored 'Trans proline' 0 N--CA 1.45 -1.069 0 C-N-CA 121.995 1.797 . . . . 0.0 110.694 177.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.4 m 70.98 -50.78 0.68 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.105 1.362 . . . . 0.0 112.444 -172.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.2 mt -54.22 -42.75 70.17 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 119.023 0.829 . . . . 0.0 111.441 -173.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.458 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -55.99 -11.06 0.93 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 178.109 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.6 tttp -52.98 -34.75 57.43 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.288 0.949 . . . . 0.0 109.846 169.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -73.54 62.73 1.89 Allowed Glycine 0 CA--C 1.533 1.21 0 N-CA-C 110.641 -0.983 . . . . 0.0 110.641 171.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 52.2 ttm -67.12 -72.39 0.17 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.649 0.779 . . . . 0.0 110.118 -170.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 m -54.16 -37.14 64.11 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.483 0.713 . . . . 0.0 110.489 174.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.54 -17.41 1.24 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.635 1.574 . . . . 0.0 112.841 176.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.7 tp -46.13 -41.2 12.14 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.656 1.116 . . . . 0.0 110.041 170.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -53.55 -55.55 24.59 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.354 0.597 . . . . 0.0 110.937 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -68.01 -49.07 63.75 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.483 0.713 . . . . 0.0 109.45 -174.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.6 tp -52.07 -59.13 4.72 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.698 0.799 . . . . 0.0 108.976 177.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -56.85 -43.68 81.4 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.032 0.533 . . . . 0.0 110.804 -178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.51 -42.75 78.89 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.037 0.38 . . . . 0.0 111.19 176.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -71.12 -38.38 72.31 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.189 0.596 . . . . 0.0 110.174 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -68.87 -51.21 42.7 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.934 1.694 . . . . 0.0 110.406 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 66.0 t0 -78.76 66.95 4.37 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.016 0.927 . . . . 0.0 109.38 -169.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -70.11 67.71 0.3 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.719 2.007 . . . . 0.0 109.997 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 176.83 -36.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 127.66 2.384 . . . . 0.0 108.465 -172.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.57 40.29 86.19 Favored Glycine 0 C--N 1.338 0.666 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -73.07 -18.83 61.28 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 122.667 -0.313 . . . . 0.0 110.604 176.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.85 0.73 90.4 Favored Glycine 0 CA--C 1.531 1.082 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -142.93 163.14 33.59 Favored 'General case' 0 N--CA 1.447 -0.622 0 C-N-CA 126.553 1.941 . . . . 0.0 107.017 177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 24.4 t -119.59 115.71 48.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 C-N-CA 125.988 1.715 . . . . 0.0 108.243 -173.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 95.8 p -81.1 163.71 22.95 Favored 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 124.238 1.015 . . . . 0.0 110.565 176.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -55.07 -32.95 62.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.119 0.485 . . . . 0.0 111.025 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -62.99 -34.25 77.15 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.015 0.926 . . . . 0.0 112.069 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -82.74 -42.09 18.43 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -57.6 -44.04 85.13 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.816 0.846 . . . . 0.0 111.262 -177.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -60.48 -24.67 65.46 Favored 'General case' 0 CA--C 1.529 0.137 0 O-C-N 120.754 -1.216 . . . . 0.0 112.427 178.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.8 t -70.31 -48.14 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 C-N-CA 119.747 -0.781 . . . . 0.0 108.919 170.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -48.81 -42.48 36.16 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.129 -0.357 . . . . 0.0 110.447 172.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 78.0 t -53.34 -36.71 27.16 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 O-C-N 121.591 -0.693 . . . . 0.0 111.792 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -62.65 -29.84 70.93 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.249 -0.907 . . . . 0.0 110.79 177.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -78.46 -49.16 13.94 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.035 0.934 . . . . 0.0 110.111 177.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.3 pt -63.0 -37.06 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-N 118.475 0.579 . . . . 0.0 111.171 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.5 p 65.82 -57.7 0.33 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 127.989 2.515 . . . . 0.0 112.722 -172.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 . . . . . 0 C--O 1.251 1.183 0 C-N-CA 126.064 1.746 . . . . 0.0 112.76 179.304 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 52.2 tptt . . . . . 0 N--CA 1.474 0.747 0 CA-C-O 120.338 0.113 . . . . 0.0 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.74 -55.01 45.42 Favored Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-O 117.897 -1.049 . . . . 0.0 112.896 -169.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.89 -48.96 14.75 Favored 'Trans proline' 0 N--CA 1.457 -0.639 0 C-N-CA 122.563 2.176 . . . . 0.0 112.38 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -63.86 -46.49 84.75 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 123.812 0.845 . . . . 0.0 110.184 -178.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -57.5 -48.26 79.73 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.4 mt -63.24 -39.73 95.43 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.735 0.814 . . . . 0.0 110.449 -179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -54.86 -53.17 58.86 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.517 0.727 . . . . 0.0 109.826 170.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.06 -55.7 26.81 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 61.0 mt -46.8 -61.25 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.236 0 C-N-CA 124.302 1.041 . . . . 0.0 109.114 174.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -46.63 -56.8 5.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.637 0.775 . . . . 0.0 110.964 -178.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 66.2 mt-10 -55.04 -47.12 75.2 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.72 0.408 . . . . 0.0 111.605 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -59.81 -47.18 86.76 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.948 -0.47 . . . . 0.0 111.023 -178.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -61.59 -53.94 49.54 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 118.487 0.585 . . . . 0.0 110.933 174.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.99 -52.92 8.3 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.302 0.641 . . . . 0.0 112.02 176.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.33 -20.84 1.19 Allowed 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 176.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -70.38 -32.44 70.11 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.668 1.122 . . . . 0.0 111.192 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -95.98 -175.1 3.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.423 0.689 . . . . 0.0 110.556 176.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -58.33 -53.36 46.41 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 123.465 0.555 . . . . 0.0 112.677 -176.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -84.07 117.28 68.29 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 117.809 0.805 . . . . 0.0 109.642 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -74.39 5.01 3.94 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.533 2.155 . . . . 0.0 113.938 -174.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -144.47 38.56 1.26 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 119.344 0.975 . . . . 0.0 111.571 174.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.28 145.98 29.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 122.191 -0.318 . . . . 0.0 110.704 175.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.4 mt -114.76 108.35 16.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.377 0.671 . . . . 0.0 110.342 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.7 t -65.77 161.55 20.61 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 168.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 67.4 mttm -38.66 -51.08 1.66 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.625 1.17 . . . . 0.0 113.042 -179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -66.79 -41.49 87.56 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -64.63 -42.94 95.14 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.0 tp -56.2 -61.78 2.16 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 172.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -46.59 -46.15 19.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 119.538 1.063 . . . . 0.0 111.732 -178.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 47.3 tp -68.4 -29.36 68.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.676 1.19 . . . . 0.0 109.741 -170.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.553 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.3 tt -79.32 -58.65 3.11 Favored 'General case' 0 N--CA 1.435 -1.179 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 174.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -45.95 -60.94 1.96 Allowed 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.928 2.091 . . . . 0.0 111.914 -170.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.18 -46.63 79.29 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -177.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 28.6 m -65.69 -49.61 67.9 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.483 0.713 . . . . 0.0 111.704 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -83.03 -36.09 25.25 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 122.687 0.395 . . . . 0.0 111.08 -171.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -124.56 61.1 27.99 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 123.583 0.753 . . . . 0.0 110.685 -173.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -74.08 65.7 5.17 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 124.054 3.169 . . . . 0.0 111.978 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.1 m -160.53 -68.48 0.07 Allowed 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.095 0.958 . . . . 0.0 110.284 174.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.6 tp -78.32 60.64 2.59 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.404 0.681 . . . . 0.0 110.799 -169.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.558 HD12 ' H ' ' A' ' 41' ' ' LYS . 0.6 OUTLIER -179.04 -44.79 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.265 1.026 . . . . 0.0 112.114 -173.078 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.558 ' H ' HD12 ' A' ' 40' ' ' LEU . 2.8 tmtm? 61.15 -68.31 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.036 1.734 . . . . 0.0 110.445 -168.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 118.99 101.63 2.0 Favored Glycine 0 CA--C 1.524 0.605 0 C-N-CA 124.795 1.188 . . . . 0.0 111.577 171.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.1 pmm? -164.29 -150.85 0.15 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.776 1.63 . . . . 0.0 107.077 170.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.1 p -46.18 -32.26 2.88 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 126.183 1.793 . . . . 0.0 112.74 176.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 m -47.1 -28.19 1.66 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.738 1.615 . . . . 0.0 112.92 175.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp -51.39 -45.2 62.41 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 118.174 0.443 . . . . 0.0 109.921 174.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -60.29 -46.23 90.56 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 -176.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.39 -54.85 40.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 60.1 tp -50.36 -55.84 13.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.968 0.507 . . . . 0.0 109.749 178.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 12.5 t80 -51.16 -48.48 61.85 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 124.101 0.961 . . . . 0.0 111.074 178.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.08 -44.52 94.72 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.367 0.53 . . . . 0.0 111.241 179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.85 -36.77 80.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.301 0.64 . . . . 0.0 110.814 -178.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -79.36 -56.81 4.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.985 1.714 . . . . 0.0 109.774 -173.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -80.17 48.75 1.03 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.933 1.693 . . . . 0.0 112.605 -168.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -56.0 -39.23 71.58 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.11 0.781 . . . . 0.0 113.11 -170.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.63 -48.11 7.79 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.857 0.463 . . . . 0.0 110.8 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.51 -36.22 44.56 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.228 -0.762 . . . . 0.0 112.314 -171.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 37.8 t0 34.83 56.49 0.74 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.386 1.874 . . . . 0.0 112.552 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 166.16 -46.68 0.27 Allowed Glycine 0 CA--C 1.525 0.692 0 N-CA-C 109.895 -1.282 . . . . 0.0 109.895 -173.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -136.36 129.25 31.02 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.633 1.173 . . . . 0.0 109.246 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 51.4 t -87.37 115.05 27.32 Favored 'Isoleucine or valine' 0 C--O 1.232 0.136 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -84.23 156.44 22.0 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 124.994 1.318 . . . . 0.0 109.99 178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -55.23 -31.94 61.9 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.477 0.656 . . . . 0.0 111.985 -178.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.5 mp0 -57.01 -43.97 82.36 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 123.868 0.867 . . . . 0.0 110.555 174.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -77.63 -38.71 47.36 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 -178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -59.78 -37.4 78.97 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 121.676 -0.64 . . . . 0.0 110.715 176.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -56.59 -34.1 66.86 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.303 -1.498 . . . . 0.0 112.117 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -64.09 -44.76 97.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 119.283 0.947 . . . . 0.0 109.022 170.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -51.75 -41.82 61.88 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.799 -0.563 . . . . 0.0 110.558 170.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.53 -36.36 53.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-N 119.339 0.972 . . . . 0.0 111.615 178.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -64.64 -48.21 75.67 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.81 -0.556 . . . . 0.0 109.588 174.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -61.97 -46.66 88.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.3 pt -63.74 -30.59 50.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.893 0.769 . . . . 0.0 110.045 172.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.1 m 64.2 49.91 2.51 Favored 'General case' 0 C--N 1.34 0.18 0 C-N-CA 125.648 1.579 . . . . 0.0 109.726 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.483 -1.722 . . . . 0.0 111.62 -170.577 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.7 -48.35 91.1 Favored Pre-proline 0 N--CA 1.451 -0.414 0 CA-C-O 118.147 -0.93 . . . . 0.0 113.276 -169.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -52.4 -47.24 28.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.016 1.811 . . . . 0.0 112.046 175.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -68.04 -43.28 79.06 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.625 0.77 . . . . 0.0 110.02 -177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.36 -52.02 64.89 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.551 0.74 . . . . 0.0 109.239 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.5 mt -64.25 -37.35 87.18 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.236 0.614 . . . . 0.0 110.427 -179.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.8 tttm -57.96 -48.28 80.42 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 118.597 0.635 . . . . 0.0 110.312 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.9 -55.56 27.21 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 177.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -50.21 -62.21 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 123.721 0.808 . . . . 0.0 109.417 176.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -43.25 -54.53 4.5 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 125.032 1.333 . . . . 0.0 110.443 178.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -61.2 -46.82 88.91 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.253 1.021 . . . . 0.0 110.449 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -60.71 -45.7 93.2 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.226 -0.296 . . . . 0.0 110.927 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -58.14 -58.79 6.89 Favored 'General case' 0 C--O 1.227 -0.124 0 CA-C-N 118.075 0.398 . . . . 0.0 111.396 173.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -44.77 -53.04 7.82 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.318 1.447 . . . . 0.0 111.724 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.41 -31.41 9.58 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.7 mttp -58.32 -33.0 69.01 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.27 0.941 . . . . 0.0 111.121 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -100.45 38.84 1.44 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.189 0.519 . . . . 0.0 109.996 172.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.94 -69.8 2.4 Favored Glycine 0 CA--C 1.524 0.648 0 O-C-N 121.453 -0.779 . . . . 0.0 111.229 173.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.65 103.45 0.37 Allowed Pre-proline 0 CA--C 1.534 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.161 -174.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -64.69 -22.37 64.32 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.126 1.884 . . . . 0.0 110.855 -177.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 p-10 -88.82 1.31 55.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-O 116.253 -1.832 . . . . 0.0 113.059 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -150.77 142.35 23.56 Favored 'General case' 0 C--N 1.348 0.504 0 N-CA-C 117.453 2.39 . . . . 0.0 117.453 -168.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 59.7 mt -111.23 126.22 54.64 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 125.3 1.44 . . . . 0.0 110.467 176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 77.5 p -71.99 171.32 12.05 Favored 'General case' 0 C--O 1.224 -0.249 0 O-C-N 121.307 -0.87 . . . . 0.0 109.513 169.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -47.85 -45.3 30.01 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.104 0.866 . . . . 0.0 111.207 168.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -62.16 -52.04 65.41 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -61.2 -42.18 98.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.292 0.568 . . . . 0.0 110.361 -177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.92 -48.95 79.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 125.77 1.628 . . . . 0.0 109.691 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -59.56 -47.67 84.64 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.343 -0.848 . . . . 0.0 110.272 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.9 tp -52.09 -59.79 3.95 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.016 0.926 . . . . 0.0 111.208 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.268 1.3 pt? -68.77 -34.86 76.28 Favored 'General case' 0 C--O 1.226 -0.174 0 C-N-CA 118.93 -1.108 . . . . 0.0 111.82 -175.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.41 -43.45 94.35 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 119.628 1.104 . . . . 0.0 110.679 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -55.27 -53.98 49.23 Favored 'General case' 0 C--O 1.227 -0.104 0 CA-C-N 119.639 1.109 . . . . 0.0 110.466 172.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -65.38 -54.24 31.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.014 -169.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -81.43 -37.63 27.76 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.475 0.71 . . . . 0.0 111.728 -174.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -131.07 63.24 69.59 Favored Pre-proline 0 CA--C 1.537 0.457 0 C-N-CA 123.555 0.742 . . . . 0.0 112.549 -168.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.45 74.71 0.38 Allowed 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 124.204 3.269 . . . . 0.0 112.692 -173.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 41.8 t -168.67 -60.34 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.168 1.787 . . . . 0.0 108.843 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 73.0 mt -79.77 49.44 1.05 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.309 1.043 . . . . 0.0 112.743 -169.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.427 HD13 ' N ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -165.83 3.51 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.146 1.378 . . . . 0.0 112.953 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -77.65 69.42 3.89 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.442 -0.786 . . . . 0.0 110.556 -172.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -174.96 93.45 0.09 OUTLIER Glycine 0 CA--C 1.526 0.749 0 N-CA-C 108.871 -1.692 . . . . 0.0 108.871 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 95.9 mmm -49.98 -55.29 15.2 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.26 1.024 . . . . 0.0 111.001 -175.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.5 p -61.33 -55.81 27.49 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.298 1.039 . . . . 0.0 109.576 174.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -48.07 -31.38 5.42 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.005 1.722 . . . . 0.0 113.205 -176.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.1 tp -49.51 -43.29 45.36 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 123.4 0.68 . . . . 0.0 109.733 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.26 -50.16 72.12 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 122.539 0.336 . . . . 0.0 110.323 -179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.08 -53.39 50.4 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.468 0.707 . . . . 0.0 109.892 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.3 tp -50.43 -57.72 7.36 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.541 0.736 . . . . 0.0 109.254 178.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -52.73 -48.87 66.39 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 123.957 0.903 . . . . 0.0 111.322 177.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -55.92 -46.13 78.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 118.538 0.608 . . . . 0.0 111.209 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -71.14 -40.6 71.26 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-O 121.025 0.441 . . . . 0.0 110.593 -176.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.64 -55.89 25.76 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.305 1.442 . . . . 0.0 109.442 177.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -80.81 51.72 1.58 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.184 1.794 . . . . 0.0 111.85 -169.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -49.64 -44.09 47.27 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.371 1.069 . . . . 0.0 113.412 -169.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.05 -48.33 7.04 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.144 0.577 . . . . 0.0 110.888 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.72 -35.32 55.2 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.643 -170.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.3 t0 31.59 56.48 0.29 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.792 2.037 . . . . 0.0 113.055 -175.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 169.03 -48.75 0.22 Allowed Glycine 0 CA--C 1.526 0.748 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 73.8 mm-40 -134.0 127.96 33.39 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.736 1.214 . . . . 0.0 108.946 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.7 t -87.26 114.14 25.83 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 C-N-CA 125.236 1.414 . . . . 0.0 108.694 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 2.5 m -77.75 154.31 32.12 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 124.804 1.242 . . . . 0.0 110.284 174.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -48.24 -41.01 26.4 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.446 0.641 . . . . 0.0 111.571 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -64.46 -36.09 83.06 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.067 0.547 . . . . 0.0 110.601 -177.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -74.75 -44.7 48.39 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -51.37 -40.62 59.59 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.496 0.718 . . . . 0.0 110.474 174.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -55.37 -32.93 63.0 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.647 -0.658 . . . . 0.0 111.903 177.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.8 t -61.57 -41.85 91.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 121.186 -0.946 . . . . 0.0 109.719 172.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.09 -44.32 97.53 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 172.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 94.5 t -54.53 -40.28 49.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 O-C-N 121.442 -0.786 . . . . 0.0 111.723 176.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -53.35 -43.55 67.81 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.264 0.938 . . . . 0.0 110.474 173.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -70.92 -40.6 72.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.406 0.682 . . . . 0.0 112.209 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.3 pt -65.16 -39.96 87.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 119.56 1.073 . . . . 0.0 109.777 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.8 m 72.18 -48.71 0.68 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.938 2.095 . . . . 0.0 114.193 173.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 26.8 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 117.641 -1.171 . . . . 0.0 110.141 -168.833 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.04 -49.37 69.34 Favored Pre-proline 0 N--CA 1.45 -0.443 0 CA-C-O 118.057 -0.973 . . . . 0.0 113.589 -169.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.17 -46.8 21.43 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.814 1.676 . . . . 0.0 112.061 176.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.5 tp10 -72.34 -38.53 68.58 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.801 0.441 . . . . 0.0 110.646 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -55.72 -55.36 33.12 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.998 -0.438 . . . . 0.0 110.013 174.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.69 -33.53 76.09 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.865 -0.588 . . . . 0.0 110.3 -179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -56.9 -50.72 71.67 Favored 'General case' 0 C--O 1.225 -0.21 0 CA-C-N 119.261 0.937 . . . . 0.0 110.517 170.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.65 -52.32 49.04 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 54.4 mt -51.95 -62.29 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.775 0.83 . . . . 0.0 109.519 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -42.47 -55.47 3.44 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.643 1.177 . . . . 0.0 110.179 178.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -57.86 -52.45 65.45 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 123.904 0.881 . . . . 0.0 111.752 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -62.11 -38.66 89.75 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.769 -0.772 . . . . 0.0 111.72 -176.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -61.98 -60.56 3.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.595 0.634 . . . . 0.0 111.189 169.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.91 -48.14 16.23 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 125.609 1.564 . . . . 0.0 113.498 -177.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -46.35 -29.12 1.54 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.859 1.264 . . . . 0.0 113.41 177.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -57.86 -33.77 69.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 119.066 0.848 . . . . 0.0 111.29 177.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -91.03 25.14 2.54 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.443 0.697 . . . . 0.0 111.529 173.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.81 -64.03 3.06 Favored Glycine 0 CA--C 1.526 0.735 0 O-C-N 121.206 -0.934 . . . . 0.0 110.962 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -60.72 111.26 3.82 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 117.65 0.725 . . . . 0.0 109.756 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -67.74 -18.32 47.67 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 121.699 1.6 . . . . 0.0 111.48 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -106.16 35.96 2.75 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.018 0.927 . . . . 0.0 111.013 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -160.5 136.08 8.14 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 116.738 2.125 . . . . 0.0 116.738 175.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 83.8 mt -113.81 123.12 49.05 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.169 1.788 . . . . 0.0 110.234 177.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.9 p -66.0 167.23 10.13 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.1 -1.0 . . . . 0.0 110.147 169.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.513 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 60.2 mtpt -43.56 -47.56 7.39 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.38 -0.825 . . . . 0.0 111.709 167.141 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 53.2 mp0 -67.25 -46.84 72.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -176.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -62.02 -44.99 95.54 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.197 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.5 tp -58.58 -49.42 77.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -52.15 -53.8 38.51 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 118.934 0.788 . . . . 0.0 110.084 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.28 -51.15 71.17 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.265 1.026 . . . . 0.0 108.531 -170.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.552 HD23 ' C ' ' A' ' 31' ' ' LEU . 2.9 tt -56.58 -55.77 29.74 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 114.135 -1.393 . . . . 0.0 108.378 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.5 mp -55.79 -40.75 73.13 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.981 0.809 . . . . 0.0 111.227 -177.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -62.7 -49.78 73.73 Favored 'General case' 0 N--CA 1.457 -0.105 0 CA-C-N 119.218 0.917 . . . . 0.0 109.076 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 23.5 m -66.35 -51.51 56.43 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.709 -173.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -83.9 -41.64 17.2 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.259 1.024 . . . . 0.0 111.535 -172.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -125.38 61.55 35.83 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.145 0.978 . . . . 0.0 111.78 -170.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.06 72.28 2.1 Favored 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 123.646 2.897 . . . . 0.0 111.253 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.6 p -174.79 -65.4 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.093 0 C-N-CA 124.747 1.219 . . . . 0.0 109.337 -177.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 52.6 mt -50.3 -31.51 14.53 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.676 1.59 . . . . 0.0 114.102 -169.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.584 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -72.52 -18.44 61.65 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 179.157 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.422 ' N ' HD22 ' A' ' 40' ' ' LEU 0.362 0.0 OUTLIER 51.45 -65.19 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 128.5 2.72 . . . . 0.0 114.478 -168.993 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -125.06 168.31 17.2 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.62 1.105 . . . . 0.0 110.525 175.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 64.7 mtm -65.68 -49.03 70.07 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.006 -0.703 . . . . 0.0 109.793 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.2 m -49.62 -44.82 47.64 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.774 1.23 . . . . 0.0 111.86 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.21 -10.55 4.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.977 0.911 . . . . 0.0 113.279 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp -55.78 -45.02 78.24 Favored 'General case' 0 C--O 1.22 -0.467 0 CA-C-N 119.515 1.052 . . . . 0.0 108.31 169.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -56.06 -49.51 73.58 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 121.037 0.446 . . . . 0.0 109.874 -177.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.09 -54.66 34.38 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.305 0.642 . . . . 0.0 110.125 -179.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.4 tp -54.77 -56.04 23.53 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.513 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 19.2 t80 -52.87 -47.0 68.15 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 124.699 1.199 . . . . 0.0 110.782 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.4 tp10 -58.38 -41.21 84.31 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 117.93 0.332 . . . . 0.0 111.077 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -71.69 -39.23 70.36 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.349 0.595 . . . . 0.0 110.462 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.3 tt -74.05 -55.44 6.11 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.919 1.688 . . . . 0.0 110.443 -171.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -79.19 40.3 0.41 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.697 1.199 . . . . 0.0 113.814 -167.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.61 67.72 7.69 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.165 -0.96 . . . . 0.0 111.577 -172.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 177.43 -49.91 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 127.469 2.308 . . . . 0.0 108.095 170.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -76.47 -43.0 20.95 Favored Glycine 0 CA--C 1.528 0.896 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 177.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 66.13 -46.51 0.42 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 128.04 2.536 . . . . 0.0 114.737 176.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.94 -41.39 7.16 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 118.981 0.809 . . . . 0.0 111.866 173.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -138.07 136.78 37.14 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.189 0.996 . . . . 0.0 109.813 -176.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.7 t -87.76 117.26 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 C-N-CA 126.464 1.905 . . . . 0.0 109.186 -172.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.5 m -81.66 156.4 25.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.171 0.988 . . . . 0.0 110.343 175.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -52.9 -38.28 61.57 Favored 'General case' 0 C--O 1.226 -0.161 0 CA-C-N 118.589 0.631 . . . . 0.0 111.005 -175.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -61.02 -39.83 91.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.4 0.68 . . . . 0.0 110.379 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.51 -44.36 62.34 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -54.55 -39.32 67.59 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 122.882 0.473 . . . . 0.0 111.199 177.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -58.98 -27.5 65.46 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.168 -0.958 . . . . 0.0 111.469 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.0 t -63.31 -44.67 99.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.318 -0.864 . . . . 0.0 109.203 169.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 73' ' ' ILE . 16.9 tp -56.3 -47.1 79.34 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 171.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 49.3 t -55.45 -45.6 78.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 119.765 1.166 . . . . 0.0 111.362 178.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -58.11 -32.03 67.72 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.474 -0.766 . . . . 0.0 111.62 174.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -69.18 -55.67 9.93 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.753 0.706 . . . . 0.0 111.006 170.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.408 HG23 ' O ' ' A' ' 69' ' ' LEU . 1.0 OUTLIER -54.69 -39.43 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 118.814 0.734 . . . . 0.0 110.605 -173.666 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 69.25 44.91 0.91 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.441 1.096 . . . . 0.0 111.391 174.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 . . . . . 0 C--O 1.251 1.146 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 168.749 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 tptm . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 110.571 -0.159 . . . . 0.0 110.571 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -52.76 -51.38 74.39 Favored Pre-proline 0 CA--C 1.535 0.396 0 CA-C-O 118.358 -0.829 . . . . 0.0 112.762 -173.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_exo -52.59 -46.22 34.78 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.018 1.812 . . . . 0.0 111.915 177.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.4 mp0 -67.39 -43.17 81.98 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.575 0.75 . . . . 0.0 110.264 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.19 -52.18 65.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 10.5 mp -61.87 -37.12 83.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.025 -0.512 . . . . 0.0 110.46 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp -56.47 -51.85 66.91 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 119.112 0.869 . . . . 0.0 110.649 171.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.44 -55.02 30.67 Favored Glycine 0 CA--C 1.528 0.881 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 81.9 mt -49.18 -59.77 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 123.762 0.825 . . . . 0.0 109.39 176.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.1 t80 -48.2 -57.91 5.26 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.929 1.292 . . . . 0.0 110.392 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -54.6 -46.42 73.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.302 0.641 . . . . 0.0 111.399 179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -59.29 -48.94 79.72 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.927 -0.483 . . . . 0.0 110.951 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.402 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 34.3 m-85 -59.05 -56.82 17.32 Favored 'General case' 0 CA--C 1.527 0.078 0 CA-C-N 118.055 0.388 . . . . 0.0 111.216 175.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.21 -53.93 3.88 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.852 1.261 . . . . 0.0 111.365 176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.76 -28.12 8.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -59.05 -31.22 68.66 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 119.603 1.092 . . . . 0.0 110.853 174.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -83.17 12.71 4.85 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.094 1.758 . . . . 0.0 111.421 174.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.37 -59.46 3.66 Favored Glycine 0 CA--C 1.529 0.926 0 O-C-N 120.457 -1.402 . . . . 0.0 110.466 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -52.11 113.97 4.87 Favored Pre-proline 0 CA--C 1.534 0.355 0 C-N-CA 123.852 0.861 . . . . 0.0 109.575 176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.73 2.5 6.91 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 122.039 1.826 . . . . 0.0 113.322 -172.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -153.17 28.15 0.51 Allowed 'General case' 0 C--N 1.342 0.268 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -172.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -147.62 136.65 22.19 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.605 0.639 . . . . 0.0 110.722 174.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' A' ' 27' ' ' GLU . 52.8 mt -107.11 108.91 20.6 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.996 0.918 . . . . 0.0 110.795 -175.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 42.2 t -64.94 163.57 14.26 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.051 -1.03 . . . . 0.0 109.136 167.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -38.63 -42.71 0.81 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 125.811 1.644 . . . . 0.0 112.073 174.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.48 -45.83 82.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 122.305 -0.247 . . . . 0.0 111.59 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.453 ' HB3' HD22 ' A' ' 23' ' ' LEU . 15.6 mp0 -62.72 -48.17 80.38 Favored 'General case' 0 N--CA 1.455 -0.182 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 175.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.18 -47.65 80.69 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.79 0.836 . . . . 0.0 110.376 -174.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -46.87 86.17 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 121.545 -0.722 . . . . 0.0 109.546 176.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.8 tp -59.37 -52.94 63.47 Favored 'General case' 0 N--CA 1.451 -0.407 0 O-C-N 121.958 -0.464 . . . . 0.0 110.683 -173.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.402 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.259 1.1 pt? -71.37 -34.12 70.15 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 119.79 -0.764 . . . . 0.0 111.679 -175.184 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.0 mp -67.14 -42.25 84.73 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.214 176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -58.99 -48.51 81.32 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 119.228 0.922 . . . . 0.0 111.265 173.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 m -63.72 -56.38 16.1 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.066 0.46 . . . . 0.0 110.844 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.42 -34.64 18.67 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.584 1.154 . . . . 0.0 112.495 -168.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -127.32 59.62 38.18 Favored Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 124.16 0.984 . . . . 0.0 111.374 -171.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -60.08 154.63 50.03 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 122.564 2.176 . . . . 0.0 110.085 178.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.3 m 69.53 -48.35 0.61 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.702 1.601 . . . . 0.0 112.759 -172.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 19.1 mt -57.23 -31.87 65.96 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.291 1.036 . . . . 0.0 112.017 -176.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.5 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -60.36 -15.04 22.07 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 173.012 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.1 pttt 48.84 49.12 19.56 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.488 1.915 . . . . 0.0 114.243 170.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 99.52 143.64 14.94 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 124.301 0.953 . . . . 0.0 111.38 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.5 ttm -66.7 -55.27 15.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.212 -0.581 . . . . 0.0 110.64 -173.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -48.3 -45.34 34.85 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.234 1.013 . . . . 0.0 111.108 178.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.29 -21.02 1.22 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 126.557 1.943 . . . . 0.0 113.322 178.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.27 -41.66 50.92 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 123.71 0.804 . . . . 0.0 110.114 174.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.12 -51.07 70.77 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.169 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.22 -54.46 29.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 57.7 tp -50.3 -55.61 14.74 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.486 0.715 . . . . 0.0 109.79 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -53.03 -51.46 61.64 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.109 0.564 . . . . 0.0 110.331 177.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -57.51 -38.57 74.86 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 118.434 0.561 . . . . 0.0 112.162 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -70.19 -33.78 72.15 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.237 0.615 . . . . 0.0 110.195 178.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -80.39 -56.13 4.41 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.628 1.171 . . . . 0.0 110.824 -173.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -80.02 40.87 0.49 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.462 1.505 . . . . 0.0 114.816 -166.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -50.46 -47.89 56.74 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -170.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -88.28 -34.32 17.74 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.242 0.617 . . . . 0.0 110.472 173.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -57.33 -33.94 66.79 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 126.69 2.09 . . . . 0.0 113.709 -174.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.6 t0 32.62 56.83 0.41 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.322 2.249 . . . . 0.0 112.63 172.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 134.32 -45.32 1.12 Allowed Glycine 0 CA--C 1.525 0.679 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.341 -172.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -138.62 134.08 33.28 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.115 0.957 . . . . 0.0 110.579 -175.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 53.6 t -87.96 119.49 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 C-N-CA 124.097 0.959 . . . . 0.0 109.651 -174.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 84.3 p -82.56 158.03 23.27 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.914 0.886 . . . . 0.0 111.132 175.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -55.61 -37.61 68.37 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.127 0.489 . . . . 0.0 110.801 -177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -56.59 -47.47 79.5 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.833 1.253 . . . . 0.0 109.973 176.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -69.8 -36.98 76.13 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 121.385 0.612 . . . . 0.0 109.61 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.5 t80 -56.27 -37.52 69.93 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.797 -0.564 . . . . 0.0 110.74 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.7 mm-40 -55.77 -35.96 66.81 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 120.645 -1.284 . . . . 0.0 111.896 171.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 t -64.56 -48.76 83.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -48.77 -40.76 30.05 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.417 0.687 . . . . 0.0 111.583 175.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.3 t -44.97 -42.98 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.93 175.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -66.52 -26.47 67.16 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 122.05 -0.406 . . . . 0.0 110.969 -175.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -79.26 -58.69 3.09 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 175.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 26.0 pt -54.71 -39.35 46.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.185 -175.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.0 m 71.83 -55.59 0.66 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.369 1.467 . . . . 0.0 111.486 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 . . . . . 0 C--O 1.25 1.113 0 C-N-CA 125.963 1.705 . . . . 0.0 110.727 169.473 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.0 tptm . . . . . 0 N--CA 1.475 0.777 0 CA-C-O 120.319 0.104 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.88 -49.41 74.17 Favored Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-O 117.877 -1.059 . . . . 0.0 113.187 -171.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -50.45 -47.11 25.95 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 122.043 1.829 . . . . 0.0 112.552 177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -67.7 -46.14 73.11 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.365 0.666 . . . . 0.0 109.844 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -55.24 -50.98 68.07 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.27 0.557 . . . . 0.0 109.544 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.7 mt -65.92 -37.49 86.2 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.94 0.896 . . . . 0.0 110.212 -177.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -57.03 -50.31 73.12 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.863 0.756 . . . . 0.0 110.353 170.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.17 -55.39 28.5 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.267 -0.733 . . . . 0.0 111.267 178.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.1 mt -50.93 -58.87 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 175.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.1 t80 -46.39 -57.68 4.43 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.988 1.315 . . . . 0.0 111.026 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.39 -37.88 88.3 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.267 0.485 . . . . 0.0 111.071 -175.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 64.6 mttm -61.79 -43.79 98.15 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.74 -0.6 . . . . 0.0 111.022 177.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -60.02 -58.25 9.37 Favored 'General case' 0 N--CA 1.455 -0.211 0 O-C-N 122.018 -0.426 . . . . 0.0 111.199 171.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.467 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -43.07 -53.53 4.83 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.214 1.006 . . . . 0.0 111.492 178.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -47.56 -32.39 5.36 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -59.96 -31.24 69.69 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 119.339 0.972 . . . . 0.0 110.846 177.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -84.47 12.7 6.44 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.062 1.745 . . . . 0.0 111.399 175.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.8 -60.16 3.77 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 120.491 -1.381 . . . . 0.0 110.618 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 40.7 t0 -52.87 112.21 3.31 Favored Pre-proline 0 CA--C 1.535 0.401 0 C-N-CA 123.856 0.862 . . . . 0.0 108.984 174.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -74.22 -5.25 16.69 Favored 'Trans proline' 0 N--CA 1.454 -0.822 0 C-N-CA 122.05 1.833 . . . . 0.0 113.01 -171.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -142.33 27.83 1.71 Allowed 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.087 0.858 . . . . 0.0 113.155 -169.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.467 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 0.1 OUTLIER -154.31 140.71 18.71 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.026 0.83 . . . . 0.0 112.445 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.1 mt -114.62 112.54 23.05 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.527 1.131 . . . . 0.0 111.58 -175.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 83.1 p -62.05 165.08 5.93 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.989 -1.069 . . . . 0.0 110.112 168.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -40.67 -46.74 2.66 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 123.915 0.886 . . . . 0.0 111.705 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -59.61 -52.44 65.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 122.496 0.318 . . . . 0.0 110.242 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -65.87 -39.75 90.99 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.035 0.445 . . . . 0.0 110.082 -176.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.26 -49.14 78.29 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.81 1.644 . . . . 0.0 109.261 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 33.9 ttpt -58.82 -46.85 86.69 Favored 'General case' 0 N--CA 1.447 -0.582 0 O-C-N 121.386 -0.821 . . . . 0.0 110.315 173.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.8 tp -52.54 -58.64 6.12 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.41 -0.806 . . . . 0.0 111.824 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.279 1.2 pt? -69.97 -34.74 73.77 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 119.246 -0.982 . . . . 0.0 112.099 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -63.3 -42.06 99.0 Favored 'General case' 0 C--N 1.338 0.099 0 CA-C-N 119.535 1.062 . . . . 0.0 110.542 175.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -57.21 -52.91 63.43 Favored 'General case' 0 CA--C 1.527 0.064 0 CA-C-N 119.232 0.924 . . . . 0.0 110.924 171.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.9 m -62.32 -52.22 64.52 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 120.436 -0.505 . . . . 0.0 110.722 -172.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -89.11 -34.96 16.55 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.07 0.948 . . . . 0.0 112.89 -168.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -124.59 81.23 60.48 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -168.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -45.56 150.92 1.26 Allowed 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.597 3.531 . . . . 0.0 113.156 169.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.5 t 69.85 -56.38 0.57 Allowed 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.118 1.767 . . . . 0.0 111.919 -175.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 47.3 tp -53.56 -35.61 60.97 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.229 1.012 . . . . 0.0 111.49 -174.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.425 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -56.94 -13.53 2.76 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 176.683 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.405 ' N ' HD22 ' A' ' 40' ' ' LEU . 33.9 ttpt -76.98 45.61 0.44 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.205 1.366 . . . . 0.0 112.668 -169.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -78.52 59.66 4.07 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 109.901 -1.28 . . . . 0.0 109.901 174.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 92.1 mtp -59.21 103.13 0.16 Allowed 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 15.1 m 68.64 -54.21 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.841 2.056 . . . . 0.0 110.978 -169.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.5 p -43.83 -18.37 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.836 2.855 . . . . 0.0 115.135 173.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.69 -41.65 32.34 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 120.539 1.518 . . . . 0.0 108.681 168.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -54.16 -51.94 62.71 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 122.17 0.188 . . . . 0.0 110.955 177.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -64.05 -53.56 47.93 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 123.328 0.651 . . . . 0.0 110.097 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.9 tp -50.05 -57.44 7.6 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.602 0.761 . . . . 0.0 109.119 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -54.1 -46.26 72.06 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.856 0.863 . . . . 0.0 111.403 177.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.92 -44.48 86.9 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.808 0.731 . . . . 0.0 111.026 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -72.45 -46.01 56.92 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 120.868 0.366 . . . . 0.0 110.179 -176.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.06 -59.56 4.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.379 1.472 . . . . 0.0 109.048 177.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -80.37 47.53 0.93 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 125.93 1.692 . . . . 0.0 110.556 -173.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ttmm -57.07 -34.42 68.26 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -167.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.39 -50.34 5.86 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.079 0.552 . . . . 0.0 110.869 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -73.19 -39.44 52.62 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.278 -171.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.9 t0 36.39 54.12 1.03 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.368 1.867 . . . . 0.0 112.469 -174.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.68 -57.6 0.08 OUTLIER Glycine 0 CA--C 1.525 0.683 0 N-CA-C 109.106 -1.598 . . . . 0.0 109.106 -175.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -132.39 137.94 47.52 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.455 1.102 . . . . 0.0 108.582 172.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 44.1 t -88.22 114.7 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 126.02 1.728 . . . . 0.0 108.569 -176.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 92.7 p -76.47 159.57 30.29 Favored 'General case' 0 C--N 1.335 -0.047 0 C-N-CA 123.741 0.816 . . . . 0.0 110.53 172.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -55.33 -34.79 64.52 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.499 0.666 . . . . 0.0 111.174 -178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.88 -49.44 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 124.093 0.957 . . . . 0.0 110.393 174.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -71.65 -40.27 69.8 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -55.22 -41.85 72.58 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 121.796 -0.565 . . . . 0.0 110.601 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -57.59 -31.72 66.47 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.482 -0.761 . . . . 0.0 112.365 176.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.4 t -63.58 -28.84 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.558 -0.714 . . . . 0.0 110.932 171.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -74.08 -45.46 49.1 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.202 -0.936 . . . . 0.0 108.608 169.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 90.9 t -54.34 -45.77 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.267 -0.896 . . . . 0.0 111.76 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 2.5 pptp? -59.33 -21.55 59.94 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.335 -0.853 . . . . 0.0 111.913 178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -78.67 -54.0 6.57 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.513 0.597 . . . . 0.0 109.577 169.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.41 -35.13 36.17 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 118.521 0.6 . . . . 0.0 111.559 -176.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 18.8 m 75.13 -37.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.013 1.725 . . . . 0.0 113.278 173.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 . . . . . 0 C--O 1.252 1.185 0 CA-C-O 117.223 -1.37 . . . . 0.0 111.834 176.03 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.32 -50.66 55.7 Favored Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-O 117.647 -1.168 . . . . 0.0 112.85 -176.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.82 -44.37 31.95 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.266 1.977 . . . . 0.0 112.711 176.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -71.67 -42.25 67.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 122.896 0.478 . . . . 0.0 110.312 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -56.29 -52.08 65.84 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.142 0.496 . . . . 0.0 109.86 174.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.4 mt -64.14 -37.9 89.11 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.522 0.729 . . . . 0.0 109.826 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -55.88 -52.59 63.56 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 118.292 0.497 . . . . 0.0 110.047 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.01 -55.68 20.12 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -56.25 -54.75 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -46.25 -54.81 8.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.793 1.237 . . . . 0.0 109.626 177.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.5 mt-10 -59.59 -44.93 93.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.467 0.707 . . . . 0.0 110.824 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -61.25 -45.22 95.42 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 117.957 0.344 . . . . 0.0 111.375 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 30.5 m-85 -60.79 -60.51 3.68 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 122.013 -0.429 . . . . 0.0 111.084 172.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.35 -49.78 6.87 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 126.037 1.735 . . . . 0.0 112.758 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.36 -32.28 11.03 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.956 0.903 . . . . 0.0 113.396 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -62.8 -30.99 71.89 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.243 -0.911 . . . . 0.0 110.797 176.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.54 24.21 1.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.688 1.195 . . . . 0.0 110.753 170.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.75 -66.36 2.76 Favored Glycine 0 CA--C 1.527 0.784 0 O-C-N 121.273 -0.892 . . . . 0.0 111.175 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -67.63 114.01 17.39 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 123.154 0.582 . . . . 0.0 109.822 -175.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -64.89 -22.23 63.34 Favored 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.167 1.911 . . . . 0.0 111.942 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -105.86 35.57 2.85 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.362 0.665 . . . . 0.0 110.787 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -160.09 132.48 6.39 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.671 1.123 . . . . 0.0 113.93 176.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.7 mt -106.86 152.76 23.47 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 125.889 1.676 . . . . 0.0 107.047 172.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.8 p -94.45 174.07 7.31 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 168.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.503 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 22.9 pttp -53.21 -38.93 63.32 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 119.649 1.113 . . . . 0.0 112.337 167.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.7 -51.88 63.07 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -62.64 -40.42 96.95 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.267 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tp -60.84 -49.86 75.79 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.132 0.573 . . . . 0.0 109.476 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -53.89 -51.04 64.98 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.621 -0.674 . . . . 0.0 109.978 175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.5 tp -51.16 -62.23 1.74 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.416 0.686 . . . . 0.0 111.676 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.408 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.269 1.0 OUTLIER -70.79 -30.64 67.16 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.341 -0.944 . . . . 0.0 112.876 -176.156 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.3 mp -64.28 -42.99 96.15 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 120.398 1.453 . . . . 0.0 109.63 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -58.32 -50.54 73.25 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.856 0.753 . . . . 0.0 110.838 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 m -61.15 -56.03 25.48 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.044 0.449 . . . . 0.0 110.719 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -87.13 -40.7 14.39 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.089 1.356 . . . . 0.0 112.078 -169.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 8.1 m-30 -120.68 57.05 5.42 Favored Pre-proline 0 CA--C 1.537 0.446 0 C-N-CA 123.872 0.869 . . . . 0.0 111.033 -170.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -58.96 155.31 39.44 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.189 1.926 . . . . 0.0 109.941 -179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.9 m 70.08 -42.9 0.53 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.172 1.389 . . . . 0.0 113.283 -174.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 17.5 mt -60.08 -37.58 80.34 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 119.721 1.146 . . . . 0.0 111.098 -176.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.463 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -63.58 -16.88 62.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 173.868 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? 67.4 -64.38 0.26 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.855 2.062 . . . . 0.0 111.671 -179.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -170.67 176.83 44.05 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 109.826 -1.31 . . . . 0.0 109.826 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -52.02 66.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.963 0.381 . . . . 0.0 111.857 -177.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.3 m -52.14 -48.87 64.65 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.393 0.677 . . . . 0.0 111.559 -176.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.44 -18.95 32.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.666 1.187 . . . . 0.0 112.944 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.2 tp -52.71 -40.09 62.67 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 119.433 1.015 . . . . 0.0 109.227 170.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.75 -53.01 60.62 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 118.672 0.669 . . . . 0.0 110.495 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -62.5 -58.25 8.28 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.8 mp -53.36 -52.7 58.41 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.503 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 7.6 t80 -57.43 -45.85 84.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 122.703 0.401 . . . . 0.0 110.641 179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -58.28 -41.68 84.9 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 118.062 0.392 . . . . 0.0 111.336 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -69.89 -44.12 70.4 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 121.526 0.679 . . . . 0.0 109.768 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.6 tt -70.55 -52.22 23.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 125.272 1.429 . . . . 0.0 110.851 -172.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -75.87 74.4 2.8 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.063 0.945 . . . . 0.0 109.691 -172.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -53.52 -33.68 55.38 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 124.34 1.056 . . . . 0.0 111.788 174.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.98 -22.68 66.48 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.37 0.508 . . . . 0.0 112.37 176.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 54.28 41.05 69.86 Favored Glycine 0 CA--C 1.526 0.733 0 C-N-CA 124.817 1.198 . . . . 0.0 112.201 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -110.54 4.32 20.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.699 1.2 . . . . 0.0 112.109 -177.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 10.58 85.13 Favored Glycine 0 CA--C 1.533 1.166 0 CA-C-N 118.308 0.504 . . . . 0.0 111.918 -177.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -134.3 168.89 18.06 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.026 1.33 . . . . 0.0 109.285 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 67.5 t -139.55 109.39 3.92 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.05 1.34 . . . . 0.0 107.52 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.7 m -80.71 161.02 24.78 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 122.825 0.45 . . . . 0.0 111.098 170.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -51.55 -38.97 56.84 Favored 'General case' 0 C--N 1.339 0.118 0 CA-C-O 121.423 0.63 . . . . 0.0 110.753 -173.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.09 -38.3 90.62 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.057 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -71.27 -45.35 63.34 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -52.4 -40.51 62.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 122.894 0.478 . . . . 0.0 110.966 177.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -55.52 -30.78 61.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 122.983 0.513 . . . . 0.0 111.882 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.4 t -61.7 -41.01 88.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 121.371 -0.831 . . . . 0.0 109.645 172.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -48.46 81.61 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 172.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 68.0 t -53.01 -43.82 48.78 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 O-C-N 121.724 -0.61 . . . . 0.0 111.485 179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 9.4 mtpm? -55.52 -30.77 61.29 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.641 -0.662 . . . . 0.0 111.935 175.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.5 ttpm? -76.66 -52.03 10.41 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.516 0.598 . . . . 0.0 110.427 172.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.64 38.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 119.046 0.839 . . . . 0.0 111.609 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 31.4 m 73.58 -64.32 0.4 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 127.078 2.151 . . . . 0.0 112.576 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.107 -0.949 . . . . 0.0 112.073 -176.272 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 54.6 tttt . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.515 0.197 . . . . 0.0 111.351 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -47.84 -49.59 57.13 Favored Pre-proline 0 N--CA 1.45 -0.453 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -169.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.47 -54.3 5.29 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.03 1.82 . . . . 0.0 112.604 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -74.26 -35.96 63.82 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.387 0.275 . . . . 0.0 111.71 -177.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -56.97 -56.56 20.2 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.558 0.694 . . . . 0.0 109.303 176.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.64 -31.31 70.36 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 118.417 -0.801 . . . . 0.0 110.298 -179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -55.79 -50.24 71.01 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.706 1.139 . . . . 0.0 110.381 169.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -52.39 -55.41 22.35 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 110.599 -1.0 . . . . 0.0 110.599 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.403 HD13 HG21 ' A' ' 9' ' ' ILE . 48.5 mt -54.43 -59.12 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -42.32 -54.71 3.65 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.784 1.234 . . . . 0.0 110.539 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -63.53 -45.04 92.44 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.707 0.803 . . . . 0.0 110.062 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -59.9 -45.47 92.45 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 122.32 -0.238 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.1 m-85 -61.02 -58.85 6.7 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.15 0.432 . . . . 0.0 111.329 173.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -43.72 -46.84 7.72 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.398 1.479 . . . . 0.0 112.748 177.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.33 -30.81 8.1 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.668 1.187 . . . . 0.0 113.681 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -73.28 -27.89 61.81 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.42 0.555 . . . . 0.0 111.14 177.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -72.3 151.31 42.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.295 1.438 . . . . 0.0 109.451 -178.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -45.83 -45.86 13.73 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 124.129 0.871 . . . . 0.0 112.238 172.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -88.58 105.3 9.3 Favored Pre-proline 0 CA--C 1.533 0.327 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 169.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -66.56 -9.17 23.26 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.361 2.041 . . . . 0.0 113.648 -169.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -118.0 28.14 8.57 Favored 'General case' 0 CA--C 1.527 0.091 0 CA-C-N 119.055 0.843 . . . . 0.0 110.741 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -149.37 156.4 41.99 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 118.147 0.43 . . . . 0.0 112.018 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 54.2 mt -110.24 110.32 21.1 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.917 0.887 . . . . 0.0 109.202 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.6 p -69.33 163.54 24.89 Favored 'General case' 0 C--O 1.224 -0.279 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 169.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 99.3 mttt -39.16 -46.09 1.41 Allowed 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 124.202 1.001 . . . . 0.0 113.343 177.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -74.38 -32.63 62.81 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.191 0.451 . . . . 0.0 112.077 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -69.23 -45.58 69.46 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 174.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.93 -46.22 82.17 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.264 1.425 . . . . 0.0 109.434 175.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -57.38 -53.3 59.68 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 121.585 -0.697 . . . . 0.0 109.75 173.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.3 tp -54.28 -53.37 54.61 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 122.878 0.471 . . . . 0.0 111.171 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.285 1.2 pt? -70.89 -35.17 72.21 Favored 'General case' 0 C--N 1.341 0.205 0 C-N-CA 118.903 -1.119 . . . . 0.0 112.081 -176.556 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.63 -36.59 84.13 Favored 'General case' 0 C--O 1.226 -0.169 0 CA-C-N 119.591 1.087 . . . . 0.0 110.185 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.21 -51.85 67.28 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 118.765 0.711 . . . . 0.0 109.808 173.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -63.75 -56.23 17.15 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.05 0.452 . . . . 0.0 110.032 -174.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -83.56 -36.99 23.56 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 124.239 1.016 . . . . 0.0 111.842 -169.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -130.01 56.51 24.94 Favored Pre-proline 0 CA--C 1.541 0.599 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -169.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.75 72.38 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 124.458 3.439 . . . . 0.0 111.24 -177.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.0 m -177.05 -39.15 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 127.91 2.484 . . . . 0.0 109.161 -175.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.66 -46.38 84.32 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 110.231 -172.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.567 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -73.36 71.82 1.28 Allowed 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.533 0.733 . . . . 0.0 109.315 172.221 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.19 76.68 0.09 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.634 1.173 . . . . 0.0 110.089 -178.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.65 102.63 1.64 Allowed Glycine 0 CA--C 1.523 0.586 0 N-CA-C 106.931 -2.468 . . . . 0.0 106.931 -169.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 57.5 ttm -31.79 -48.99 0.16 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.158 2.183 . . . . 0.0 114.648 -169.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 m -40.98 -37.91 0.89 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 126.03 1.732 . . . . 0.0 113.709 176.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 38.7 p -54.97 -16.98 3.15 Favored 'General case' 0 C--N 1.338 0.103 0 CA-C-O 118.022 -0.989 . . . . 0.0 113.477 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.9 tp -46.42 -41.32 13.58 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-N 119.632 1.105 . . . . 0.0 109.749 169.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -54.01 -55.75 24.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 122.205 0.202 . . . . 0.0 110.861 176.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.63 -47.99 68.03 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -173.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 77.3 mt -50.91 -61.95 1.9 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.427 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 12.7 t80 -55.22 -44.37 75.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.323 0.51 . . . . 0.0 111.267 -178.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -56.64 -43.8 80.67 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 122.348 0.259 . . . . 0.0 111.085 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -72.21 -43.37 64.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.465 0.65 . . . . 0.0 109.863 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.73 -51.53 54.86 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.985 1.714 . . . . 0.0 110.562 -171.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -77.3 71.87 3.81 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.523 0.729 . . . . 0.0 109.673 -172.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -46.43 -43.12 16.21 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.573 1.549 . . . . 0.0 111.956 178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.06 -19.47 63.28 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.431 0.692 . . . . 0.0 112.424 -178.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.52 83.08 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.667 -0.973 . . . . 0.0 110.667 -169.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -76.17 -12.58 60.12 Favored 'General case' 0 CA--C 1.534 0.33 0 O-C-N 122.531 -0.393 . . . . 0.0 111.501 -177.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.44 6.78 88.85 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 110.396 -1.082 . . . . 0.0 110.396 -169.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -147.95 160.67 42.57 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.47 1.908 . . . . 0.0 107.315 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 42.4 t -116.43 115.39 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 125.54 1.536 . . . . 0.0 108.098 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.8 p -73.6 166.61 22.95 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 124.392 1.077 . . . . 0.0 110.622 175.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -53.2 -43.65 67.35 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.115 0.483 . . . . 0.0 110.156 171.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.3 mp0 -64.16 -46.82 82.36 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 122.932 0.493 . . . . 0.0 109.724 -176.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -60.94 -47.01 88.39 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.25 0.548 . . . . 0.0 109.652 175.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.9 t80 -54.1 -39.89 66.8 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.857 0.863 . . . . 0.0 111.181 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -56.2 -27.34 54.28 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.422 -0.799 . . . . 0.0 111.902 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 22.5 t -66.85 -46.86 84.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 119.102 0.865 . . . . 0.0 109.189 170.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -40.53 69.65 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 123.417 0.687 . . . . 0.0 109.856 174.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 82.4 t -54.7 -28.29 19.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 O-C-N 121.378 -0.826 . . . . 0.0 112.173 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -67.52 -38.59 84.47 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 120.002 -1.686 . . . . 0.0 110.435 173.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.32 -43.08 78.37 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.963 0.505 . . . . 0.0 110.366 178.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.8 -37.29 79.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 119.624 -0.83 . . . . 0.0 109.773 174.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.3 m 74.09 -42.88 0.52 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 126.838 2.055 . . . . 0.0 112.639 177.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.551 1.14 . . . . 0.0 111.254 173.666 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.8 pttt . . . . . 0 N--CA 1.477 0.879 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -46.44 -54.6 17.56 Favored Pre-proline 0 N--CA 1.453 -0.298 0 CA-C-O 117.665 -1.159 . . . . 0.0 111.564 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -40.58 -45.57 4.57 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.032 2.488 . . . . 0.0 114.622 170.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -72.4 -42.5 65.08 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 118.886 0.766 . . . . 0.0 110.297 -176.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -57.08 -51.73 68.11 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.71 -41.28 90.46 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 124.088 0.955 . . . . 0.0 110.268 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -56.72 -51.36 69.13 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 118.334 0.516 . . . . 0.0 110.046 173.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.54 -56.75 18.45 Favored Glycine 0 CA--C 1.529 0.938 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 177.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.4 mt -49.89 -58.63 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 123.952 0.901 . . . . 0.0 109.289 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -47.57 -55.55 9.0 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.479 1.512 . . . . 0.0 110.402 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -58.65 -45.71 88.73 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.132 0.573 . . . . 0.0 111.618 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -58.92 -49.17 78.83 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.131 -0.355 . . . . 0.0 110.827 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.409 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 24.7 m-85 -58.29 -56.45 21.97 Favored 'General case' 0 C--O 1.227 -0.123 0 O-C-N 122.013 -0.43 . . . . 0.0 111.197 174.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.506 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -44.02 -51.68 7.63 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.704 1.202 . . . . 0.0 112.48 177.297 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -49.05 -30.97 6.92 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 177.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -60.67 -33.1 72.32 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.32 -0.862 . . . . 0.0 111.302 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -94.3 31.36 1.73 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.493 0.588 . . . . 0.0 111.021 171.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 77.33 -68.26 2.69 Favored Glycine 0 CA--C 1.525 0.715 0 N-CA-C 111.112 -0.795 . . . . 0.0 111.112 174.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -54.48 105.85 0.58 Allowed Pre-proline 0 CA--C 1.536 0.429 0 C-N-CA 124.847 1.259 . . . . 0.0 109.85 -177.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -80.4 32.67 0.5 Allowed 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.687 2.258 . . . . 0.0 112.329 -169.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -163.57 25.51 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.395 -0.816 . . . . 0.0 112.9 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.506 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 3.4 tt0 -150.96 142.05 23.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 122.963 0.505 . . . . 0.0 110.8 -175.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.6 mt -120.39 129.9 54.13 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.83 1.252 . . . . 0.0 107.911 177.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 t -93.55 168.07 11.27 Favored 'General case' 0 C--O 1.225 -0.204 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 167.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -48.14 -34.62 10.18 Favored 'General case' 0 N--CA 1.461 0.125 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -170.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -70.5 -40.63 73.45 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.959 -0.463 . . . . 0.0 110.742 176.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -69.4 -42.42 75.12 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.4 tp -58.51 -48.56 80.44 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 122.435 0.294 . . . . 0.0 110.987 176.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 49.3 pttt -62.69 -42.43 99.63 Favored 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 118.031 -1.468 . . . . 0.0 109.207 -179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.1 tp -54.49 -59.17 5.05 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.99 -0.444 . . . . 0.0 111.192 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HB2' ' CE2' ' A' ' 13' ' ' TYR 0.254 1.3 pt? -70.28 -35.33 73.65 Favored 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 119.032 -1.067 . . . . 0.0 112.245 -174.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.6 mp -63.43 -42.51 98.7 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 119.414 1.006 . . . . 0.0 110.119 176.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -60.22 -48.48 81.55 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.275 0.943 . . . . 0.0 111.11 173.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.1 m -61.19 -55.95 26.28 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.043 0.449 . . . . 0.0 110.562 -175.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -87.1 -38.68 16.26 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.451 1.1 . . . . 0.0 112.069 -169.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -126.75 58.88 30.83 Favored Pre-proline 0 CA--C 1.535 0.37 0 C-N-CA 124.118 0.967 . . . . 0.0 111.758 -170.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -58.88 158.76 23.52 Favored 'Trans proline' 0 N--CA 1.449 -1.125 0 C-N-CA 122.278 1.985 . . . . 0.0 110.076 178.353 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 7.6 m 70.44 -41.21 0.49 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.15 1.38 . . . . 0.0 113.466 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -59.89 -39.06 84.06 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.849 1.204 . . . . 0.0 111.082 -176.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.497 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -66.58 -9.73 38.25 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.98 1.104 . . . . 0.0 113.98 174.005 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 83.9 tttt 65.22 -69.15 0.1 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.965 2.106 . . . . 0.0 112.336 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 170.74 137.47 2.3 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.646 -0.582 . . . . 0.0 111.646 -178.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 3.5 mpp? 24.07 -97.33 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 129.013 2.925 . . . . 0.0 113.362 170.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.6 m -45.12 -40.78 7.26 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 125.994 1.718 . . . . 0.0 112.977 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -54.61 -29.92 53.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.357 0.663 . . . . 0.0 111.457 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 18.0 tp -52.68 -40.49 62.97 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.203 0.601 . . . . 0.0 110.135 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -56.74 -51.91 67.05 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 118.28 0.491 . . . . 0.0 110.014 -177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -66.9 -49.48 65.45 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.777 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.1 tp -54.51 -53.28 56.46 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -54.92 -47.89 73.8 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.486 0.714 . . . . 0.0 110.624 175.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tp10 -58.4 -40.44 82.42 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.168 0.44 . . . . 0.0 111.305 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -69.23 -47.8 63.73 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-O 121.668 0.747 . . . . 0.0 109.33 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.4 tt -64.57 -57.45 9.09 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.609 1.563 . . . . 0.0 110.537 -174.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -74.34 75.18 1.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -51.01 -37.09 42.98 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.651 1.18 . . . . 0.0 111.504 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.51 -23.67 66.28 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.616 0.766 . . . . 0.0 112.662 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.13 37.45 91.72 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.197 0.903 . . . . 0.0 112.017 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -98.83 0.03 43.45 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.034 0.934 . . . . 0.0 112.392 -178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.4 16.6 70.91 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 -177.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -142.22 160.76 39.6 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.182 0.993 . . . . 0.0 110.102 -176.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.46 103.95 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 76.5 p -68.15 173.6 4.56 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.355 0.662 . . . . 0.0 109.454 171.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -58.36 -35.87 72.62 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.737 0.78 . . . . 0.0 110.343 171.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 20.4 mp0 -62.54 -51.69 66.39 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.857 0.863 . . . . 0.0 109.727 178.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.95 -46.29 88.38 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.02 -41.5 71.4 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.51 -0.744 . . . . 0.0 111.559 -177.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -56.54 -27.81 58.53 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.455 -0.778 . . . . 0.0 112.584 176.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.53 -35.98 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 119.432 1.015 . . . . 0.0 110.484 170.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -64.88 -48.76 73.1 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 171.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 63.8 t -54.08 -42.76 56.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 122.112 -0.368 . . . . 0.0 111.03 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -51.45 -34.29 34.57 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 122.07 -0.394 . . . . 0.0 111.397 175.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.9 mtmm -82.64 -46.01 13.81 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 118.803 -0.618 . . . . 0.0 111.161 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.91 -34.04 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-N 119.863 1.211 . . . . 0.0 110.978 178.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.4 m 82.37 -50.06 0.2 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 127.036 2.135 . . . . 0.0 112.486 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 117.239 -1.363 . . . . 0.0 110.643 -177.565 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 112.424 0.527 . . . . 0.0 112.424 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.2 -49.1 63.11 Favored Pre-proline 0 CA--C 1.535 0.378 0 C-N-CA 124.402 1.081 . . . . 0.0 113.302 -172.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -51.72 -46.68 30.46 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.098 1.866 . . . . 0.0 112.109 175.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -68.85 -41.96 77.77 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.307 0.643 . . . . 0.0 110.064 -177.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -56.22 -52.11 65.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 175.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.1 mp -67.03 -34.08 76.93 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 119.405 -0.331 . . . . 0.0 110.405 -177.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -59.14 -51.06 71.66 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 118.708 0.685 . . . . 0.0 110.57 169.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.75 -54.19 34.72 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.4 mt -44.61 -64.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.249 0 C-N-CA 125.084 1.354 . . . . 0.0 109.651 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -45.25 -53.96 7.65 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.74 0.816 . . . . 0.0 110.443 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -57.16 -49.95 74.35 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.934 0.894 . . . . 0.0 111.863 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.0 ptmm? -62.16 -45.57 92.84 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.529 1.058 . . . . 0.0 110.944 -179.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -58.74 -53.55 57.11 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.88 -0.513 . . . . 0.0 110.759 177.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -53.93 19.32 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.889 1.276 . . . . 0.0 111.463 175.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.08 -39.39 59.64 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.406 -0.808 . . . . 0.0 112.105 172.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -69.63 -36.71 76.36 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.799 0.727 . . . . 0.0 110.967 179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -48.59 80.48 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.25 -57.06 0.51 Allowed Glycine 0 CA--C 1.522 0.512 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -68.31 108.77 3.11 Favored Pre-proline 0 CA--C 1.532 0.255 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -59.57 -26.69 82.87 Favored 'Trans proline' 0 N--CA 1.461 -0.413 0 C-N-CA 122.389 2.059 . . . . 0.0 111.5 -175.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 8.5 p-10 -95.6 5.82 50.5 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 116.761 -1.59 . . . . 0.0 112.774 -178.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -151.97 141.85 22.03 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -168.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.1 mt -106.65 127.76 53.62 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 125.62 1.568 . . . . 0.0 109.535 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.2 p -71.92 171.4 11.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.287 -0.883 . . . . 0.0 109.044 168.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 8.4 mtmp? -45.86 -44.61 14.49 Favored 'General case' 0 C--O 1.226 -0.173 0 O-C-N 121.637 -0.664 . . . . 0.0 110.969 167.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.2 mp0 -68.39 -47.69 66.68 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 122.746 0.418 . . . . 0.0 109.936 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -61.62 -41.74 97.9 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 177.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.48 -48.77 80.38 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.702 1.201 . . . . 0.0 109.851 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -59.87 -48.9 79.83 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 121.228 -0.92 . . . . 0.0 110.093 176.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 53.4 tp -50.98 -60.86 2.64 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.88 0.872 . . . . 0.0 111.244 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 1.1 pt? -69.18 -31.67 70.45 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 119.063 -1.055 . . . . 0.0 112.199 -174.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -65.92 -43.55 87.79 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 119.994 1.27 . . . . 0.0 110.55 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -55.84 -54.02 49.59 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.013 0.824 . . . . 0.0 110.677 171.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.0 m -65.67 -52.71 49.52 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.564 0.221 . . . . 0.0 111.289 -169.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -80.56 -39.05 28.41 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 123.634 0.773 . . . . 0.0 111.346 -175.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -126.88 62.58 51.88 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-O 118.853 -0.594 . . . . 0.0 111.364 -169.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -66.47 75.17 0.38 Allowed 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 124.711 3.607 . . . . 0.0 112.215 -173.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.2 m 176.19 -42.2 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 129.381 3.073 . . . . 0.0 108.414 -178.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -81.72 51.96 1.81 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.77 0.828 . . . . 0.0 110.535 -172.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -166.47 18.13 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.103 1.361 . . . . 0.0 112.025 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -75.31 70.4 2.22 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.481 0.713 . . . . 0.0 110.514 -173.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 167.58 84.9 0.06 OUTLIER Glycine 0 CA--C 1.524 0.642 0 N-CA-C 108.643 -1.783 . . . . 0.0 108.643 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 66.8 mtm -58.71 -59.77 4.88 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 122.412 -0.463 . . . . 0.0 110.7 -173.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.6 p -52.94 -47.14 68.29 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.852 0.861 . . . . 0.0 109.919 173.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -18.85 3.03 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.431 1.492 . . . . 0.0 113.027 178.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.1 tp -50.89 -40.55 56.93 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-N 119.651 1.114 . . . . 0.0 109.677 171.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -52.84 -57.2 11.0 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-O 121.087 0.47 . . . . 0.0 109.92 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -62.49 -52.26 64.19 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.336 0.655 . . . . 0.0 110.114 -175.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.18 -54.5 35.05 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.755 0.822 . . . . 0.0 109.141 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.468 ' CE1' ' HA ' ' A' ' 25' ' ' LYS . 38.5 t80 -57.79 -45.3 86.23 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.038 0.535 . . . . 0.0 111.337 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.91 -42.94 95.01 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.144 0.884 . . . . 0.0 111.105 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -64.19 -50.52 67.77 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.807 0.813 . . . . 0.0 109.266 -178.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -60.08 4.4 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 126.328 1.851 . . . . 0.0 109.715 -178.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -80.35 49.82 1.19 Allowed 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.908 1.683 . . . . 0.0 112.407 -168.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.86 -65.91 0.56 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.315 0.579 . . . . 0.0 109.797 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -83.79 68.29 9.86 Favored 'General case' 0 N--CA 1.455 -0.178 0 O-C-N 121.699 -0.625 . . . . 0.0 109.647 177.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 174.67 -38.01 0.11 Allowed Glycine 0 CA--C 1.526 0.78 0 CA-C-O 119.858 -0.412 . . . . 0.0 112.301 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.7 t70 67.84 -60.44 0.4 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 127.224 2.21 . . . . 0.0 113.834 174.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -97.77 -28.67 8.18 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 124.618 1.104 . . . . 0.0 112.699 -174.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -143.64 131.68 21.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.985 0.914 . . . . 0.0 110.411 -177.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 37.9 t -87.43 113.77 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 C-N-CA 127.303 2.241 . . . . 0.0 108.349 -171.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 96.7 p -79.72 165.68 22.57 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 123.095 0.558 . . . . 0.0 110.359 173.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -55.42 -33.94 63.98 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 121.037 0.446 . . . . 0.0 110.917 177.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.96 -54.82 29.36 Favored 'General case' 0 N--CA 1.457 -0.108 0 C-N-CA 123.413 0.685 . . . . 0.0 110.226 173.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -69.11 -38.63 79.01 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -58.44 -39.51 80.03 Favored 'General case' 0 C--O 1.215 -0.738 0 O-C-N 121.763 -0.586 . . . . 0.0 110.778 179.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -57.62 -35.17 70.12 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 120.464 1.484 . . . . 0.0 111.967 174.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.0 t -62.98 -39.57 85.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 121.205 -0.935 . . . . 0.0 109.3 171.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -58.39 -43.85 88.69 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.4 -0.813 . . . . 0.0 110.212 169.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.7 t -58.79 -35.35 55.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 119.587 1.085 . . . . 0.0 110.731 178.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -61.28 -59.35 5.43 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm -55.73 -44.97 78.03 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 113.634 0.975 . . . . 0.0 113.634 -173.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 20.4 pt -55.97 -23.48 15.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.112 0.869 . . . . 0.0 111.885 177.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 26.2 m 75.59 -53.37 0.64 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 126.026 1.731 . . . . 0.0 112.635 170.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.089 0 C-N-CA 125.561 1.545 . . . . 0.0 112.604 -173.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.3 tttm . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 110.537 -0.172 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.25 -51.37 42.64 Favored Pre-proline 0 N--CA 1.453 -0.323 0 CA-C-O 117.98 -1.009 . . . . 0.0 113.456 -169.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -47.62 -40.79 30.68 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.54 2.16 . . . . 0.0 113.294 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -71.1 -46.19 62.22 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.115 0.566 . . . . 0.0 109.994 -176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -58.37 -50.78 72.42 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 177.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 26.3 mt -61.38 -40.81 95.7 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.997 -178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -56.96 -50.88 71.29 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 118.556 0.616 . . . . 0.0 110.527 171.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.67 -54.47 32.78 Favored Glycine 0 CA--C 1.529 0.941 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 9' ' ' ILE . 57.1 mt -50.01 -64.36 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 123.93 0.892 . . . . 0.0 109.352 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -45.73 -52.19 11.39 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.18 1.392 . . . . 0.0 110.239 -178.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -61.82 -45.96 91.56 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.626 1.171 . . . . 0.0 110.457 -175.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -60.29 -49.04 79.19 Favored 'General case' 0 N--CA 1.456 -0.134 0 O-C-N 122.252 -0.28 . . . . 0.0 110.557 178.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 36.6 m-85 -56.28 -60.54 3.36 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 117.972 0.351 . . . . 0.0 111.388 175.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -42.28 -55.12 3.46 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 125.923 1.689 . . . . 0.0 111.914 177.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -51.14 -26.57 6.87 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -58.89 -31.84 68.96 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.68 1.127 . . . . 0.0 110.564 175.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -91.79 25.64 2.67 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.584 1.153 . . . . 0.0 110.973 174.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 76.72 -64.55 2.97 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -60.24 113.56 7.75 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 123.597 0.759 . . . . 0.0 109.709 -178.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -73.5 -20.14 21.01 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.189 1.926 . . . . 0.0 112.138 -177.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -103.09 16.46 26.57 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 117.982 -1.009 . . . . 0.0 112.643 -171.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -154.9 141.79 19.14 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -168.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.4 mt -119.99 135.19 55.01 Favored 'General case' 0 C--N 1.345 0.402 0 C-N-CA 125.658 1.583 . . . . 0.0 109.575 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 98.9 p -74.13 172.67 11.31 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.105 0.866 . . . . 0.0 109.181 168.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 0.1 OUTLIER -55.33 -38.42 68.71 Favored 'General case' 0 CA--C 1.528 0.132 0 O-C-N 121.041 -1.037 . . . . 0.0 112.152 168.306 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -61.31 -52.41 64.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.84 -40.78 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.978 -0.378 . . . . 0.0 109.978 -178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -60.55 -47.31 86.74 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.368 1.067 . . . . 0.0 110.027 178.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -57.24 -51.44 69.36 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 119.664 -0.815 . . . . 0.0 109.536 172.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.1 tp -52.6 -55.86 19.41 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 122.629 0.372 . . . . 0.0 111.773 -173.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.26 1.3 pt? -69.85 -35.55 74.82 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 119.143 -1.023 . . . . 0.0 112.249 -177.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.3 mp -64.77 -40.4 95.2 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 120.562 1.528 . . . . 0.0 109.936 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.34 -52.18 65.53 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.007 0.523 . . . . 0.0 111.003 171.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.55 -49.6 58.24 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.3 0.5 . . . . 0.0 110.462 -172.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -86.47 -37.5 18.21 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.173 0.989 . . . . 0.0 111.589 -169.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -126.47 62.04 46.15 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 124.22 1.008 . . . . 0.0 111.649 -175.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.15 73.76 0.49 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.853 3.702 . . . . 0.0 112.016 -174.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.5 m 176.92 -36.64 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 128.624 2.77 . . . . 0.0 109.675 -176.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 34.6 tp -67.13 -43.94 81.1 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 121.839 -0.538 . . . . 0.0 110.679 -169.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.568 ' CD1' ' H ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -67.59 49.85 0.05 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 127.452 2.301 . . . . 0.0 113.916 177.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.3 ptpp? -69.41 75.12 0.38 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.777 1.231 . . . . 0.0 113.36 -170.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 112.61 137.95 7.11 Favored Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.502 1.525 . . . . 0.0 110.332 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.8 pmm? -60.94 -51.36 69.62 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 122.378 -0.484 . . . . 0.0 110.318 -179.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.1 m -51.94 -46.49 64.72 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.924 0.89 . . . . 0.0 110.425 177.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -53.13 -25.59 13.81 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.23 1.412 . . . . 0.0 112.519 178.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.8 tp -55.26 -40.67 71.25 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.887 0.767 . . . . 0.0 110.008 175.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -55.48 -55.39 32.37 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -60.82 -53.74 53.71 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.069 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.48 -54.57 39.15 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.793 0.837 . . . . 0.0 109.183 -178.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.52 ' CE1' HG23 ' A' ' 61' ' ' VAL . 41.2 t80 -57.51 -45.42 84.98 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.515 0.726 . . . . 0.0 111.196 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -61.18 -45.03 96.29 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-N 118.799 0.727 . . . . 0.0 110.89 178.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.13 -47.07 84.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.559 0.695 . . . . 0.0 109.346 -176.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -61.2 2.52 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.887 1.675 . . . . 0.0 109.77 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -80.58 54.99 2.2 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.476 1.51 . . . . 0.0 111.75 -168.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -53.58 -48.44 69.19 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 123.214 0.605 . . . . 0.0 111.396 -174.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.41 -48.62 26.62 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 122.695 0.398 . . . . 0.0 111.687 -176.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -82.07 -39.82 11.09 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-O 119.628 -0.54 . . . . 0.0 112.739 -169.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.4 t0 38.19 52.79 1.65 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.713 1.605 . . . . 0.0 112.028 -170.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 174.61 -50.07 0.14 Allowed Glycine 0 CA--C 1.526 0.759 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 -172.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -138.76 128.93 25.52 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.561 1.144 . . . . 0.0 109.691 179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.52 HG23 ' CE1' ' A' ' 50' ' ' PHE . 66.3 t -87.37 99.8 9.09 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 -178.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.3 m -68.53 155.52 39.79 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 169.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -46.5 -36.99 7.25 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.542 0.686 . . . . 0.0 112.178 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -60.62 -41.19 94.32 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.718 0.807 . . . . 0.0 110.927 178.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -72.34 -40.84 67.09 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 174.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.4 -42.63 64.19 Favored 'General case' 0 C--O 1.223 -0.299 0 O-C-N 121.708 -0.62 . . . . 0.0 110.961 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -39.74 20.09 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.667 -0.645 . . . . 0.0 112.494 172.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 29.1 t -61.42 -39.84 84.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 O-C-N 121.746 -0.596 . . . . 0.0 110.149 175.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.7 tp -59.44 -51.63 69.07 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 169.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.9 t -53.54 -41.71 46.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-N 117.929 0.331 . . . . 0.0 111.057 -176.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -51.68 -37.11 49.19 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.049 0.539 . . . . 0.0 111.502 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -78.46 -50.93 10.78 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.081 0.552 . . . . 0.0 110.62 174.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -57.55 -32.04 40.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 118.831 0.741 . . . . 0.0 111.724 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.2 m 75.54 -44.27 0.52 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.944 2.098 . . . . 0.0 113.255 171.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 . . . . . 0 C--O 1.253 1.237 0 C-N-CA 125.997 1.719 . . . . 0.0 111.93 179.067 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt . . . . . 0 N--CA 1.474 0.759 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.65 -53.7 51.09 Favored Pre-proline 0 N--CA 1.45 -0.45 0 CA-C-O 117.695 -1.145 . . . . 0.0 112.403 -174.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.91 -50.75 11.14 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.367 2.045 . . . . 0.0 112.315 177.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.64 -48.04 82.66 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.192 0.597 . . . . 0.0 110.713 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -56.04 -50.17 71.67 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.764 0.426 . . . . 0.0 109.852 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.3 mt -63.65 -38.7 92.11 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.108 0.963 . . . . 0.0 109.593 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tttp -59.56 -52.37 65.83 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-N 118.271 0.487 . . . . 0.0 110.387 173.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.51 -54.22 36.06 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.793 -0.923 . . . . 0.0 110.793 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.8 mt -45.19 -64.32 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 124.558 1.143 . . . . 0.0 109.497 172.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -48.21 -56.13 8.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 125.463 1.505 . . . . 0.0 110.534 -176.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 68.9 mt-10 -56.91 -47.02 81.54 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.56 0.344 . . . . 0.0 110.889 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -60.51 -44.17 96.29 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.984 -0.448 . . . . 0.0 111.113 -179.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -59.66 -57.28 13.62 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 118.161 0.437 . . . . 0.0 111.132 174.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.58 -50.52 13.04 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.776 0.83 . . . . 0.0 111.633 178.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -53.7 -25.89 20.48 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -61.8 -36.54 81.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.445 1.021 . . . . 0.0 110.869 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.3 tm-20 -73.85 -50.53 19.92 Favored 'General case' 0 N--CA 1.457 -0.12 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 149.44 -46.58 0.65 Allowed Glycine 0 C--N 1.334 0.462 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 177.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -53.93 121.33 28.63 Favored Pre-proline 0 CA--C 1.534 0.329 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 174.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.52 -11.26 28.04 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.744 1.63 . . . . 0.0 112.772 -174.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -150.33 37.51 0.69 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.168 0.894 . . . . 0.0 112.761 -172.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -153.26 130.9 11.51 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.848 -0.532 . . . . 0.0 111.49 175.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 76.7 mt -100.67 118.98 37.9 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.026 0.93 . . . . 0.0 110.459 -174.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 2.6 m -68.68 157.33 36.48 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 166.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.1 -40.71 2.38 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 173.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.6 -53.48 54.07 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 122.646 0.378 . . . . 0.0 111.294 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.77 -44.9 94.97 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.1 tp -57.76 -47.72 81.69 Favored 'General case' 0 C--N 1.34 0.166 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.294 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -56.14 -58.45 7.9 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.069 173.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.7 tp -49.52 -55.4 13.5 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 123.337 0.398 . . . . 0.0 111.661 -173.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.271 0.7 OUTLIER -72.21 -32.36 66.7 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.719 -174.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.06 -42.85 93.83 Favored 'General case' 0 CA--C 1.523 -0.079 0 CA-C-N 120.065 1.302 . . . . 0.0 109.943 174.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.28 -47.57 81.76 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.954 -0.699 . . . . 0.0 109.928 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.3 m -69.15 -50.5 47.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.606 -173.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -87.59 -38.2 16.16 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.562 -169.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 12.5 m-30 -117.77 82.38 16.46 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -167.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -38.89 138.24 0.56 Allowed 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 125.165 3.91 . . . . 0.0 113.507 169.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 13.2 m 68.87 -46.21 0.55 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 126.31 1.844 . . . . 0.0 113.325 -175.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.2 mt -64.11 -18.45 64.42 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.04 -0.981 . . . . 0.0 111.303 178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.8 mp -14.53 -76.72 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 128.067 2.547 . . . . 0.0 110.879 166.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? 42.94 37.99 1.27 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.562 1.945 . . . . 0.0 113.118 168.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -86.94 -139.73 5.91 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.276 -0.73 . . . . 0.0 111.276 -172.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.0 tpp 50.63 -138.7 0.99 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.249 1.019 . . . . 0.0 109.791 -177.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -50.58 -49.09 57.23 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 119.307 0.958 . . . . 0.0 111.362 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.86 -18.59 34.19 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.263 1.025 . . . . 0.0 113.065 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 tp -55.28 -41.03 71.72 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 119.155 0.889 . . . . 0.0 109.6 171.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -55.79 -52.03 65.37 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -60.98 -57.0 14.45 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.45 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 56.6 tp -53.22 -53.49 49.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.955 0.502 . . . . 0.0 110.047 -177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.52 -48.06 75.27 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.303 178.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -60.49 -42.25 95.94 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.106 0.412 . . . . 0.0 111.321 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -70.0 -48.19 59.14 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 121.553 0.692 . . . . 0.0 109.624 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.45 -57.27 10.78 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 125.379 1.472 . . . . 0.0 109.557 -177.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -80.33 44.88 0.72 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.73 1.212 . . . . 0.0 112.475 -168.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttpm? -56.32 -48.51 76.56 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.071 0.949 . . . . 0.0 111.211 -172.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -109.02 82.25 1.57 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.832 1.253 . . . . 0.0 108.429 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 163.47 -42.53 0.33 Allowed Glycine 0 CA--C 1.526 0.755 0 N-CA-C 108.875 -1.69 . . . . 0.0 108.875 -177.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 69.29 -59.74 0.48 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.622 2.369 . . . . 0.0 113.686 167.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -98.01 -27.77 8.65 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 124.846 1.213 . . . . 0.0 112.499 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -136.99 127.71 27.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.236 1.014 . . . . 0.0 109.173 -172.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 55.2 t -88.69 110.88 21.83 Favored 'Isoleucine or valine' 0 C--N 1.339 0.14 0 C-N-CA 123.903 0.881 . . . . 0.0 108.653 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.7 p -74.32 166.21 23.86 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.941 0.897 . . . . 0.0 110.242 171.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -56.81 -35.86 69.24 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.453 0.644 . . . . 0.0 110.173 179.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 24.8 mp0 -61.18 -49.48 77.02 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 124.083 0.953 . . . . 0.0 110.179 177.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -64.33 -44.22 92.2 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.69 176.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -52.69 -40.9 63.39 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.665 0.786 . . . . 0.0 110.547 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.88 -35.91 46.8 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.102 0.561 . . . . 0.0 112.173 175.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.16 -38.31 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 118.698 0.681 . . . . 0.0 110.227 174.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.63 -45.68 74.67 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 173.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 57.6 t -52.92 -42.2 42.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 O-C-N 121.646 -0.659 . . . . 0.0 111.393 177.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -53.82 -31.01 47.62 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.606 -0.684 . . . . 0.0 112.004 175.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 39.9 mmtm -78.33 -51.64 9.81 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.909 0.484 . . . . 0.0 109.749 174.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.99 -34.73 45.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-N 118.212 0.46 . . . . 0.0 111.531 -176.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 m 74.81 -54.06 0.67 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.424 1.89 . . . . 0.0 112.431 171.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.229 0 CA-C-O 117.035 -1.46 . . . . 0.0 111.99 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.57 -0.159 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -53.93 48.34 Favored Pre-proline 0 N--CA 1.45 -0.458 0 CA-C-O 117.858 -1.067 . . . . 0.0 112.298 -177.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -47.5 -50.4 11.46 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.319 2.013 . . . . 0.0 112.449 177.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.98 -47.65 83.9 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.251 0.62 . . . . 0.0 110.826 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -56.41 -50.22 72.24 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.686 0.395 . . . . 0.0 110.094 178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.14 -37.2 83.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.058 0.943 . . . . 0.0 109.853 -176.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 55.2 tptt -58.53 -54.12 50.58 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.831 0.452 . . . . 0.0 109.805 171.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.17 25.61 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 179.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 15.4 mt -45.81 -62.81 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.401 1.48 . . . . 0.0 109.818 173.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -45.25 -57.51 3.93 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.49 1.116 . . . . 0.0 110.151 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -57.09 -48.15 79.3 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.238 -0.411 . . . . 0.0 112.086 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -62.81 -45.93 90.33 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 119.104 -1.038 . . . . 0.0 110.751 -178.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -56.98 -53.31 59.45 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-N 118.732 0.696 . . . . 0.0 111.285 177.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -46.46 -59.47 2.95 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.319 1.048 . . . . 0.0 110.429 175.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.49 70.18 Favored 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -63.68 -40.88 97.93 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.452 0.569 . . . . 0.0 111.53 -173.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -134.2 7.87 3.69 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 114.076 1.139 . . . . 0.0 114.076 -170.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -162.33 -153.18 7.03 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 119.948 1.249 . . . . 0.0 112.039 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.42 139.0 85.18 Favored Pre-proline 0 CA--C 1.535 0.392 0 CA-C-O 118.606 -0.712 . . . . 0.0 109.216 178.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.1 -1.67 1.86 Allowed 'Trans proline' 0 CA--C 1.535 0.529 0 C-N-CA 123.491 2.794 . . . . 0.0 115.607 -173.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -146.56 33.13 0.95 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.74 1.154 . . . . 0.0 111.067 169.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -146.84 133.25 19.63 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.912 -0.492 . . . . 0.0 112.038 177.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.442 HD22 ' HB3' ' A' ' 27' ' ' GLU . 80.5 mt -96.7 109.34 22.0 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.753 0.821 . . . . 0.0 110.321 -175.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -59.07 164.26 3.12 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 119.179 0.9 . . . . 0.0 109.316 168.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -48.21 -33.83 9.2 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 169.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -63.23 -51.91 64.32 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 118.333 0.515 . . . . 0.0 109.616 176.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.442 ' HB3' HD22 ' A' ' 23' ' ' LEU . 1.3 mp0 -57.9 -50.0 74.82 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.2 -45.67 87.17 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.065 -172.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -58.3 -56.07 26.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 O-C-N 121.775 -0.578 . . . . 0.0 109.854 171.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.4 tp -52.4 -53.22 47.92 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.891 0.476 . . . . 0.0 111.523 -172.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.252 0.9 OUTLIER -73.14 -31.73 64.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 118.283 -0.865 . . . . 0.0 112.523 -176.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.0 mp -66.39 -42.05 88.48 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 120.886 1.675 . . . . 0.0 109.157 175.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -51.03 70.18 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 122.512 0.325 . . . . 0.0 111.643 172.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 16.8 m -70.66 -50.97 31.09 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 118.453 0.569 . . . . 0.0 110.144 -173.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -83.77 -37.61 22.39 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.841 0.856 . . . . 0.0 111.024 -169.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -128.09 62.92 60.17 Favored Pre-proline 0 C--O 1.235 0.293 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.861 -172.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -60.18 80.83 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.794 3.662 . . . . 0.0 111.661 -174.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 29.4 p 177.91 -49.5 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.52 2.328 . . . . 0.0 107.964 -169.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.3 mt -78.36 53.99 1.35 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.426 1.09 . . . . 0.0 111.583 -176.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.414 HD13 ' N ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -156.31 41.29 0.37 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.817 1.247 . . . . 0.0 109.572 175.47 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -67.63 76.16 0.18 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.808 1.243 . . . . 0.0 111.693 -176.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.63 134.74 8.55 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -61.38 -55.8 27.47 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 -178.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -45.74 -46.93 15.38 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.942 1.297 . . . . 0.0 111.643 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -49.13 -28.14 4.07 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 126.372 1.869 . . . . 0.0 113.016 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 23.6 tp -53.4 -39.09 64.02 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 122.932 0.493 . . . . 0.0 110.198 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.15 -53.08 60.55 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 118.323 0.51 . . . . 0.0 110.02 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -66.1 -49.43 67.57 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 122.959 0.504 . . . . 0.0 109.732 -177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -54.27 -56.0 22.71 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -56.43 -46.29 80.32 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.724 0.809 . . . . 0.0 111.072 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -58.91 -41.45 87.29 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.149 0.431 . . . . 0.0 111.18 178.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -65.46 -43.36 90.58 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -73.48 -53.73 9.91 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.455 1.502 . . . . 0.0 111.555 -172.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -81.02 51.95 1.67 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.899 1.28 . . . . 0.0 113.784 -167.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -34.75 -61.0 0.42 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 126.195 1.798 . . . . 0.0 113.301 -172.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.14 -41.15 7.25 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.985 0.914 . . . . 0.0 110.694 -173.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -75.0 -11.31 84.0 Favored Glycine 0 CA--C 1.53 0.974 0 CA-C-O 118.134 -1.37 . . . . 0.0 113.439 -171.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.3 t0 2.23 73.37 0.0 OUTLIER 'General case' 0 C--N 1.348 0.531 0 C-N-CA 129.221 3.008 . . . . 0.0 114.254 175.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 151.18 -49.29 0.55 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 108.164 -1.974 . . . . 0.0 108.164 -169.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -145.62 137.93 25.63 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.093 0.557 . . . . 0.0 111.113 169.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 41.6 t -89.09 119.12 35.68 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 C-N-CA 126.635 1.974 . . . . 0.0 109.796 -171.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.2 m -73.49 153.56 40.28 Favored 'General case' 0 C--O 1.228 -0.077 0 C-N-CA 124.967 1.307 . . . . 0.0 109.92 172.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -50.26 -39.96 46.59 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.158 0.504 . . . . 0.0 111.408 178.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -63.28 -36.41 83.58 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.399 0.68 . . . . 0.0 110.934 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.32 -44.34 52.92 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 176.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -52.42 -40.75 62.54 Favored 'General case' 0 C--O 1.222 -0.366 0 C-N-CA 123.256 0.622 . . . . 0.0 110.313 175.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -54.82 -33.59 61.79 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.579 -0.701 . . . . 0.0 111.851 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.71 -42.8 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.375 -0.828 . . . . 0.0 109.322 173.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 tp -58.46 -47.17 84.92 Favored 'General case' 0 C--O 1.223 -0.321 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 170.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 93.3 t -54.57 -42.41 59.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 119.362 0.983 . . . . 0.0 111.68 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -54.17 -41.84 68.96 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.24 -0.912 . . . . 0.0 110.583 173.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -73.66 -36.62 65.39 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.093 0.957 . . . . 0.0 112.824 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.53 -32.52 55.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 119.763 1.165 . . . . 0.0 110.034 174.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.4 m 63.18 43.3 6.45 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.969 1.708 . . . . 0.0 111.937 171.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 116.964 -1.494 . . . . 0.0 109.149 178.696 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.499 0.19 . . . . 0.0 110.786 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 m -46.96 -49.37 50.02 Favored Pre-proline 0 N--CA 1.45 -0.435 0 CA-C-O 117.411 -1.28 . . . . 0.0 113.701 -169.034 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -47.56 -49.88 12.51 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.079 1.853 . . . . 0.0 112.944 176.109 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -75.54 -38.82 59.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 122.783 0.433 . . . . 0.0 110.559 -175.642 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -57.03 -53.21 60.67 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 121.62 0.724 . . . . 0.0 109.222 175.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 19.1 mt -61.49 -38.49 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.01 0.924 . . . . 0.0 109.739 178.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -57.98 -45.97 85.9 Favored 'General case' 0 C--N 1.338 0.108 0 CA-C-N 119.188 0.903 . . . . 0.0 111.229 172.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -57.01 -54.43 36.98 Favored Glycine 0 CA--C 1.527 0.826 0 N-CA-C 110.539 -1.024 . . . . 0.0 110.539 176.49 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.5 mt -51.91 -61.14 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 123.49 0.716 . . . . 0.0 109.452 178.026 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -43.42 -58.58 2.52 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.231 1.812 . . . . 0.0 109.981 177.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -55.94 -46.97 78.37 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 123.78 0.832 . . . . 0.0 111.292 -178.504 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -59.97 -47.48 85.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 119.32 -0.371 . . . . 0.0 111.203 179.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -61.76 -55.34 31.22 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 119.429 -0.908 . . . . 0.0 111.471 173.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -40.56 -51.55 2.93 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.354 1.862 . . . . 0.0 112.226 177.566 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -41.89 -43.07 2.93 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 175.65 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -60.43 -32.5 71.41 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.707 0.803 . . . . 0.0 111.932 -179.838 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.7 tm-20 -59.48 -38.91 82.08 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.163 0.985 . . . . 0.0 110.054 174.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 116.81 -52.64 0.67 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.011 -2.035 . . . . 0.0 108.011 -169.132 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -60.34 119.64 44.62 Favored Pre-proline 0 CA--C 1.536 0.435 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 172.029 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.88 -3.3 11.81 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.437 2.091 . . . . 0.0 113.684 -172.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -153.38 41.12 0.54 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 119.846 1.203 . . . . 0.0 111.482 178.572 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -148.06 129.03 14.44 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.916 -0.49 . . . . 0.0 111.263 174.716 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -94.86 112.12 23.86 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 124.318 1.047 . . . . 0.0 110.039 -175.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.9 t -73.14 168.32 19.33 Favored 'General case' 0 C--O 1.23 0.051 0 C-N-CA 117.791 -1.563 . . . . 0.0 108.965 167.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -38.82 -45.39 1.15 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.716 1.606 . . . . 0.0 111.992 178.595 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -64.15 -46.32 84.61 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 178.663 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -62.2 -50.08 73.23 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.325 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.0 tp -59.01 -50.52 73.76 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -175.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -51.64 -57.15 9.99 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 176.218 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -44.75 95.93 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -168.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.451 HD23 ' C ' ' A' ' 31' ' ' LEU . 4.8 tt -56.26 -57.31 12.76 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 175.064 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.6 mp -57.04 -41.3 78.42 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 121.079 -1.013 . . . . 0.0 112.043 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -63.19 -49.92 72.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.557 1.071 . . . . 0.0 109.121 -179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 26.3 m -69.96 -51.12 35.22 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.417 -171.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -81.63 -39.08 24.99 Favored 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 123.774 0.83 . . . . 0.0 110.994 -172.578 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -127.93 65.84 69.73 Favored Pre-proline 0 C--O 1.235 0.327 0 CA-C-N 118.593 0.633 . . . . 0.0 110.66 -170.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -66.59 74.93 0.4 Allowed 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 124.575 3.517 . . . . 0.0 111.287 -176.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.5 m -178.29 -43.43 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 129.564 3.146 . . . . 0.0 108.064 -174.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 74.3 mt -78.45 58.85 2.25 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.488 0.715 . . . . 0.0 111.172 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.69 39.36 0.33 Allowed 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 125.535 1.534 . . . . 0.0 109.351 174.51 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -61.95 80.38 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.071 1.348 . . . . 0.0 111.058 -172.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 109.5 7.55 27.88 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.296 1.427 . . . . 0.0 113.246 178.068 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 26.6 ttt 61.35 -70.98 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.277 1.831 . . . . 0.0 113.126 175.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 10.0 m -53.04 -31.49 41.69 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.556 1.542 . . . . 0.0 111.675 179.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.2 -14.84 0.74 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.521 1.528 . . . . 0.0 113.089 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.5 tp -47.39 -40.46 17.73 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.187 0.903 . . . . 0.0 109.215 167.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -52.22 -54.84 26.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.01 0.368 . . . . 0.0 110.697 177.303 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -63.42 -50.01 71.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.497 0.719 . . . . 0.0 109.759 -178.675 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 51.0 tp -55.63 -53.82 51.76 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -178.344 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -55.02 -46.25 75.24 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 122.914 0.485 . . . . 0.0 109.994 175.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -56.42 -45.71 80.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.202 0.455 . . . . 0.0 111.811 -179.183 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -77.01 -36.97 55.88 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.784 0.326 . . . . 0.0 110.855 -176.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.08 -47.02 69.43 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.072 1.349 . . . . 0.0 110.182 -178.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -77.5 64.44 2.83 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.756 1.222 . . . . 0.0 110.719 -169.67 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -75.84 70.91 2.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.043 1.337 . . . . 0.0 109.875 178.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . 118.17 -140.74 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 130.124 3.37 . . . . 0.0 105.393 -171.536 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.28 -54.12 3.15 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 119.644 1.111 . . . . 0.0 114.067 169.066 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.1 t0 67.07 65.79 0.43 Allowed 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 126.767 2.027 . . . . 0.0 110.511 177.126 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.44 4.47 85.86 Favored Glycine 0 CA--C 1.53 0.981 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.171 177.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -144.48 121.5 11.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.62 1.168 . . . . 0.0 109.195 178.133 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 40.8 t -87.83 115.85 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 125.145 1.378 . . . . 0.0 109.119 -176.204 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.7 p -73.74 163.05 28.49 Favored 'General case' 0 C--O 1.227 -0.092 0 C-N-CA 124.109 0.964 . . . . 0.0 111.081 173.079 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.36 -41.03 68.67 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.64 0.376 . . . . 0.0 110.016 177.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -57.98 -51.33 70.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 123.716 0.806 . . . . 0.0 110.914 177.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -61.1 -44.76 96.86 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 177.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -52.11 -41.79 62.74 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.747 0.819 . . . . 0.0 111.317 177.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -52.79 -35.53 56.79 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.8 0.727 . . . . 0.0 112.009 176.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 26.0 t -57.62 -40.6 76.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 118.439 0.563 . . . . 0.0 110.104 175.042 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 14.0 tp -66.28 -45.65 79.73 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.824 -0.547 . . . . 0.0 109.624 172.292 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.8 t -53.22 -42.28 46.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 118.347 0.521 . . . . 0.0 111.284 -178.032 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -52.22 -35.75 50.37 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 122.182 -0.324 . . . . 0.0 111.781 174.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -75.24 -54.7 6.66 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 122.706 0.403 . . . . 0.0 109.983 174.165 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 1.1 pt -56.09 -36.45 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 118.348 0.522 . . . . 0.0 111.355 -172.676 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.4 m 74.19 -49.44 0.67 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.826 1.651 . . . . 0.0 112.598 174.892 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 . . . . . 0 C--O 1.253 1.245 0 CA-C-O 117.096 -1.43 . . . . 0.0 112.147 178.201 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.5 tttt . . . . . 0 N--CA 1.474 0.728 0 CA-C-O 120.459 0.171 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -55.01 33.33 Favored Pre-proline 0 N--CA 1.451 -0.393 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.437 -174.299 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.07 -50.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.519 2.146 . . . . 0.0 112.376 176.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.25 -44.67 94.53 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.136 0.574 . . . . 0.0 110.981 -179.233 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -57.69 -51.15 70.71 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.107 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 22.7 mt -62.38 -42.17 99.21 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.336 0.654 . . . . 0.0 109.761 -178.072 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 26.0 ttpp -55.01 -51.05 67.47 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.371 0.532 . . . . 0.0 110.766 171.301 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -54.66 -55.68 26.11 Favored Glycine 0 CA--C 1.531 1.044 0 N-CA-C 111.291 -0.724 . . . . 0.0 111.291 179.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.46 -59.15 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.247 0 C-N-CA 123.907 0.883 . . . . 0.0 109.288 176.43 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -47.28 -55.18 9.19 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.911 1.284 . . . . 0.0 109.741 -179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -57.57 -47.45 82.06 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.59 0.756 . . . . 0.0 111.076 -176.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.83 -48.85 79.93 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.775 -178.465 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -57.04 -59.68 4.71 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.348 0.594 . . . . 0.0 111.064 174.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -45.9 -51.46 13.13 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 126.889 2.076 . . . . 0.0 112.154 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.5 -32.29 17.78 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.631 0.772 . . . . 0.0 112.401 177.014 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.21 -31.74 67.96 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.983 -0.532 . . . . 0.0 111.929 -178.489 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -159.3 81.2 0.76 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.808 0.813 . . . . 0.0 111.385 -169.459 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 147.87 -83.75 0.18 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 107.362 -2.295 . . . . 0.0 107.362 173.336 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -163.47 156.75 16.34 Favored Pre-proline 0 C--N 1.33 -0.248 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 174.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -45.81 -29.22 5.47 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 CA-C-N 122.075 1.777 . . . . 0.0 114.001 169.828 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -96.29 7.46 46.41 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 117.37 -1.3 . . . . 0.0 114.443 177.833 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -156.79 132.49 9.47 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -168.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.0 mt -105.8 117.03 32.97 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.865 2.066 . . . . 0.0 111.412 -174.517 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.3 m -65.49 159.49 24.31 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 120.022 1.283 . . . . 0.0 111.02 169.094 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.489 ' HA ' ' CE2' ' A' ' 50' ' ' PHE . 59.3 mtmt -37.99 -53.27 1.37 Allowed 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 125.341 1.456 . . . . 0.0 112.867 177.263 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 mp0 -65.71 -31.45 72.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 119.5 -0.286 . . . . 0.0 110.406 -175.821 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -73.77 -43.53 58.73 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 177.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.66 -45.96 77.59 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.566 0.746 . . . . 0.0 109.358 173.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -60.47 -49.05 79.09 Favored 'General case' 0 N--CA 1.448 -0.54 0 O-C-N 121.407 -0.808 . . . . 0.0 110.685 173.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.99 -60.8 2.47 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 123.548 0.739 . . . . 0.0 111.164 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.251 1.4 pt? -70.94 -33.61 70.66 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.384 -172.123 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 7.6 mp -65.43 -42.63 92.26 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.344 176.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -58.24 -50.34 73.92 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.919 1.236 . . . . 0.0 110.856 173.061 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 m -62.2 -56.71 15.98 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 120.971 0.415 . . . . 0.0 110.498 -173.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -84.25 -35.48 23.38 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.336 1.054 . . . . 0.0 111.604 -170.0 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -134.13 62.45 56.72 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.84 0.856 . . . . 0.0 112.028 -169.881 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -64.97 83.11 0.18 Allowed 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 123.78 2.987 . . . . 0.0 111.556 -174.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.0 p 154.55 -28.81 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 129.149 2.979 . . . . 0.0 110.502 -179.967 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 38.6 tp -64.2 -35.99 82.62 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.905 0.775 . . . . 0.0 110.833 -177.57 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.442 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -64.67 -19.34 65.67 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 170.667 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.5 mtmt 66.83 -59.78 0.36 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 127.267 2.227 . . . . 0.0 113.253 179.192 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.71 168.41 41.05 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 109.794 -1.322 . . . . 0.0 109.794 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 47.4 tpp -56.77 -66.61 0.42 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.579 0.752 . . . . 0.0 110.226 -173.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.9 m -51.04 -44.94 61.15 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.702 0.801 . . . . 0.0 110.789 177.316 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -25.71 21.76 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 125.289 1.436 . . . . 0.0 112.647 179.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.5 tp -53.37 -43.06 67.49 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.43 0.559 . . . . 0.0 109.6 174.04 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -55.97 -51.15 68.72 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -178.688 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.53 -54.83 33.97 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.168 0.587 . . . . 0.0 109.731 -178.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 58.4 tp -51.43 -58.15 7.05 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.489 ' CE2' ' HA ' ' A' ' 25' ' ' LYS . 27.1 t80 -54.86 -43.98 73.57 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.23 1.012 . . . . 0.0 111.214 -179.204 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.0 tp10 -57.59 -44.57 85.47 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 118.199 0.454 . . . . 0.0 111.048 179.537 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 51.0 mm-40 -72.02 -43.9 64.28 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.42 0.628 . . . . 0.0 110.126 -179.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.432 HD11 HD12 ' A' ' 69' ' ' LEU . 2.4 tt -62.04 -59.86 4.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.427 1.491 . . . . 0.0 110.253 -176.325 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 49.8 t0 -78.28 65.28 3.59 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -178.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -59.5 -29.85 68.15 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.324 0.65 . . . . 0.0 111.483 -179.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.65 -25.61 67.48 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.646 0.778 . . . . 0.0 111.984 172.276 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.75 35.96 92.7 Favored Glycine 0 C--N 1.336 0.572 0 C-N-CA 124.377 0.989 . . . . 0.0 111.881 177.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -79.39 -10.34 59.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 117.133 0.467 . . . . 0.0 111.44 178.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.39 8.48 83.3 Favored Glycine 0 CA--C 1.528 0.894 0 N-CA-C 111.373 -0.691 . . . . 0.0 111.373 -175.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -164.92 134.38 3.62 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 106.877 -1.527 . . . . 0.0 106.877 -173.349 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.443 HG23 ' CE2' ' A' ' 50' ' ' PHE . 55.8 t -88.58 103.73 14.07 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 C-N-CA 126.623 1.969 . . . . 0.0 108.776 -168.085 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.61 152.82 37.81 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.634 1.174 . . . . 0.0 109.193 175.089 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -51.01 -33.79 26.46 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.74 0.7 . . . . 0.0 111.731 176.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -55.59 -53.13 60.31 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.189 0.996 . . . . 0.0 110.584 173.106 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -62.57 -43.28 99.2 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 178.359 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -58.43 -44.65 89.22 Favored 'General case' 0 C--O 1.221 -0.436 0 O-C-N 122.048 -0.407 . . . . 0.0 111.028 -179.597 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -57.96 -37.48 74.26 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.193 -0.942 . . . . 0.0 111.635 176.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.53 -38.99 81.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 O-C-N 121.439 -0.788 . . . . 0.0 109.802 172.089 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.432 HD12 HD11 ' A' ' 53' ' ' LEU . 0.3 OUTLIER -55.7 -50.93 68.97 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.652 -0.655 . . . . 0.0 109.75 169.443 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 74.3 t -55.67 -39.64 56.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.549 0.74 . . . . 0.0 110.801 -179.569 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -53.56 -33.94 56.5 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.828 -0.545 . . . . 0.0 111.216 174.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -76.12 -52.88 9.19 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.785 0.434 . . . . 0.0 110.005 173.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.15 -32.25 33.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 O-C-N 121.89 -0.506 . . . . 0.0 111.589 -175.726 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.0 m 85.16 -42.14 0.06 Allowed 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 127.686 2.394 . . . . 0.0 112.512 170.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.151 0 CA-C-O 116.97 -1.491 . . . . 0.0 111.493 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.416 0.151 . . . . 0.0 110.66 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -51.11 55.9 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-O 118.193 -0.908 . . . . 0.0 112.825 -174.826 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -51.36 -43.93 46.46 Favored 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 122.356 2.038 . . . . 0.0 112.439 176.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -69.26 -43.75 73.29 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.189 0.596 . . . . 0.0 109.925 -177.682 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -56.73 -52.26 65.67 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 175.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 24.7 mt -60.48 -42.12 95.62 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.992 0.517 . . . . 0.0 109.87 -178.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -56.08 -51.51 67.59 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.293 0.497 . . . . 0.0 110.627 172.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.46 -53.92 37.96 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 9' ' ' ILE . 69.5 mt -50.36 -60.9 0.71 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 C-N-CA 123.63 0.772 . . . . 0.0 109.047 175.196 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -45.4 -57.11 4.3 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.07 1.348 . . . . 0.0 110.576 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.27 -47.86 77.76 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 111.765 179.676 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -59.08 -44.25 91.87 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.997 -0.439 . . . . 0.0 111.784 179.619 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -63.91 -56.26 16.62 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.808 0.731 . . . . 0.0 111.381 173.125 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.476 ' HB1' ' H ' ' A' ' 22' ' ' GLN . . . -40.97 -46.25 2.77 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.229 1.812 . . . . 0.0 112.68 178.178 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -42.11 -35.76 1.0 Allowed 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.317 1.229 . . . . 0.0 114.317 174.541 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.5 mptt -63.77 -27.94 69.53 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.063 -1.023 . . . . 0.0 111.349 178.754 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.23 5.81 4.14 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.161 1.384 . . . . 0.0 111.498 170.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.48 -62.89 3.75 Favored Glycine 0 CA--C 1.527 0.836 0 O-C-N 120.223 -1.548 . . . . 0.0 109.536 -172.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -61.48 113.7 8.88 Favored Pre-proline 0 CA--C 1.535 0.387 0 C-N-CA 123.064 0.546 . . . . 0.0 109.917 177.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -79.97 35.81 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.589 2.193 . . . . 0.0 111.94 -173.544 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -159.89 22.19 0.17 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 177.806 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.476 ' H ' ' HB1' ' A' ' 14' ' ' ALA . 2.5 tt0 -151.69 135.67 16.52 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.173 0.589 . . . . 0.0 109.769 -177.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.528 HD22 ' HB3' ' A' ' 27' ' ' GLU . 70.3 mt -111.5 123.01 49.35 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.15 1.38 . . . . 0.0 109.891 -175.099 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.4 t -84.44 168.96 15.03 Favored 'General case' 0 C--N 1.335 -0.058 0 CA-C-N 120.431 1.468 . . . . 0.0 109.476 168.927 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -38.48 -47.84 1.32 Allowed 'General case' 0 C--O 1.226 -0.158 0 C-N-CA 126.152 1.781 . . . . 0.0 110.743 178.365 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -51.69 -55.44 19.5 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.296 0.638 . . . . 0.0 111.513 176.145 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.528 ' HB3' HD22 ' A' ' 23' ' ' LEU . 16.1 mp0 -62.43 -44.77 95.64 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.595 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.3 tp -59.26 -47.67 84.47 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 119.765 -0.159 . . . . 0.0 110.86 -173.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -55.36 -55.45 31.38 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 121.211 -0.931 . . . . 0.0 109.531 173.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.2 tp -51.84 -55.32 20.72 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 124.718 1.261 . . . . 0.0 110.416 -172.599 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . 0.276 0.8 OUTLIER -75.35 -32.82 61.0 Favored 'General case' 0 N--CA 1.455 -0.188 0 CA-C-O 118.539 -0.743 . . . . 0.0 111.793 -175.487 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.6 mp -68.16 -44.25 76.42 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 120.266 1.394 . . . . 0.0 110.854 178.898 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -51.59 68.18 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.109 174.6 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 51.5 m -66.3 -52.51 46.57 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 121.163 -0.215 . . . . 0.0 111.279 -171.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 123.581 0.752 . . . . 0.0 111.347 -170.772 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.418 ' CD2' HD11 ' A' ' 73' ' ' ILE . 23.6 m-85 -125.05 56.33 13.22 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -169.492 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_exo -40.0 141.88 0.62 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.751 2.968 . . . . 0.0 113.515 173.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.8 m 73.5 -38.24 0.4 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.337 1.455 . . . . 0.0 113.332 178.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.73 62.03 1.04 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.605 1.093 . . . . 0.0 110.135 176.204 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 174.18 -12.06 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 130.242 3.417 . . . . 0.0 111.421 -177.387 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 70.44 -64.13 0.38 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 126.327 1.851 . . . . 0.0 110.668 -178.565 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 173.64 122.23 0.66 Allowed Glycine 0 CA--C 1.524 0.648 0 N-CA-C 110.964 -0.855 . . . . 0.0 110.964 177.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.4 mpt? 26.46 -92.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 128.448 2.699 . . . . 0.0 114.054 169.129 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.7 m -44.69 -42.13 7.34 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 126.065 1.746 . . . . 0.0 113.056 -177.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.5 m -54.67 -30.34 55.21 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.052 0.941 . . . . 0.0 111.48 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.84 -33.94 69.17 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-O 119.003 -0.522 . . . . 0.0 110.561 176.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -55.24 -43.38 74.54 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 119.243 0.929 . . . . 0.0 110.422 178.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -67.95 -58.68 4.13 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.298 0.639 . . . . 0.0 109.472 175.157 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -50.15 -50.03 50.26 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.851 0.86 . . . . 0.0 110.628 -174.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -51.32 -39.8 57.71 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.847 1.659 . . . . 0.0 111.053 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.5 tp10 -61.32 -35.26 76.91 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 117.908 0.322 . . . . 0.0 110.727 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -80.19 -44.94 18.92 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.17 -56.52 20.72 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.68 1.192 . . . . 0.0 110.022 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -79.86 65.73 5.12 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.711 0.804 . . . . 0.0 109.87 -172.596 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -54.87 -29.49 55.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.078 0.951 . . . . 0.0 112.018 176.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.03 -24.99 66.06 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.835 0.454 . . . . 0.0 112.148 176.04 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.17 74.35 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 123.451 0.548 . . . . 0.0 111.966 -178.464 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -76.49 -18.04 58.96 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 117.467 0.634 . . . . 0.0 111.717 179.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.77 18.03 79.3 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 108.254 -1.939 . . . . 0.0 108.254 -165.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -157.98 154.03 27.07 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 126.901 2.081 . . . . 0.0 107.745 -169.508 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 76.7 t -117.98 112.92 40.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 125.681 1.592 . . . . 0.0 108.037 -172.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.6 p -67.52 162.55 23.05 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 123.185 0.594 . . . . 0.0 110.611 175.556 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -54.34 -37.45 64.92 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.608 0.718 . . . . 0.0 110.478 169.592 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -59.46 -56.79 17.54 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.933 0.893 . . . . 0.0 110.084 177.542 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -59.93 -42.01 93.04 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.433 0.635 . . . . 0.0 110.046 179.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -54.74 -47.73 73.46 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.69 177.114 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -60.64 -28.27 68.42 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.602 -0.686 . . . . 0.0 112.408 178.09 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.4 t -64.24 -50.97 74.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 169.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.43 -39.18 69.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 122.175 -0.328 . . . . 0.0 111.539 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 69.0 t -44.8 -38.85 1.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 124.529 1.132 . . . . 0.0 111.825 175.252 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -59.79 -35.06 73.89 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.066 -0.396 . . . . 0.0 111.432 -179.497 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -79.05 -47.06 16.87 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 172.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.418 HD11 ' CD2' ' A' ' 36' ' ' PHE . 0.1 OUTLIER -49.14 -39.44 12.48 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 124.955 1.302 . . . . 0.0 110.945 -177.333 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 19.3 m 72.55 -52.52 0.7 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.934 1.694 . . . . 0.0 112.586 176.266 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 117.616 -1.183 . . . . 0.0 110.16 174.431 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.3 -48.0 86.95 Favored Pre-proline 0 CA--C 1.538 0.49 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.209 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.13 -43.09 61.52 Favored 'Trans proline' 0 N--CA 1.457 -0.633 0 C-N-CA 122.122 1.881 . . . . 0.0 112.231 174.25 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -67.85 -40.69 83.63 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.351 0.661 . . . . 0.0 109.669 -178.727 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.68 -53.02 61.73 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.526 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 41.3 mt -62.19 -37.69 86.27 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.437 -178.96 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -56.42 -50.71 70.84 Favored 'General case' 0 CA--C 1.527 0.07 0 CA-C-N 118.681 0.673 . . . . 0.0 110.296 171.689 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -55.69 -52.85 45.65 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 178.418 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.402 HG21 HD13 ' A' ' 9' ' ' ILE . 53.8 mt -52.78 -60.1 1.33 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 C-N-CA 123.721 0.808 . . . . 0.0 109.362 177.407 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -46.86 -54.35 10.12 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 124.699 1.2 . . . . 0.0 109.863 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -57.13 -51.36 69.6 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.158 0.983 . . . . 0.0 110.679 -178.109 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 35.0 mtmm -58.33 -47.66 83.05 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.913 -0.492 . . . . 0.0 111.557 -179.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.411 ' CE2' ' HB2' ' A' ' 31' ' ' LEU . 29.3 m-85 -54.0 -62.17 1.83 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.33 0.586 . . . . 0.0 110.967 171.468 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.54 -45.0 46.95 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 125.54 1.536 . . . . 0.0 113.335 -174.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -50.68 -30.82 14.64 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.692 0.797 . . . . 0.0 112.486 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -80.44 -85.54 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 118.111 0.414 . . . . 0.0 110.58 176.09 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -97.57 70.24 2.23 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.37 -0.831 . . . . 0.0 110.037 -168.413 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 169.22 -75.33 0.11 Allowed Glycine 0 CA--C 1.523 0.573 0 N-CA-C 111.217 -0.753 . . . . 0.0 111.217 170.654 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -178.75 147.23 0.53 Allowed Pre-proline 0 C--N 1.332 -0.173 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -169.692 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -24.6 -50.39 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 1 C-N-CA 125.426 4.084 . . . . 0.0 115.64 172.752 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -134.18 48.74 2.31 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 173.688 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -146.5 134.94 21.96 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.915 -0.49 . . . . 0.0 111.684 168.519 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 87.1 mt -101.88 124.97 48.4 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.58 1.152 . . . . 0.0 111.111 -176.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 86.5 p -63.55 164.47 9.45 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.358 0.981 . . . . 0.0 108.982 167.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 50' ' ' PHE . 4.9 ptpp? -52.32 -38.28 58.13 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 121.078 -1.014 . . . . 0.0 112.473 169.337 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -61.39 -49.92 74.95 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.371 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -63.15 -41.92 99.35 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 122.218 -0.302 . . . . 0.0 111.242 178.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -59.94 -43.61 94.85 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.33 1.052 . . . . 0.0 109.154 178.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 52.3 tttm -55.91 -58.53 7.47 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 169.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.27 -60.45 2.12 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.353 1.061 . . . . 0.0 111.561 -173.192 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.411 ' HB2' ' CE2' ' A' ' 13' ' ' TYR . 1.4 pt? -67.35 -33.12 74.56 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.775 -174.944 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.9 mp -65.88 -37.43 86.13 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 119.376 -0.93 . . . . 0.0 110.073 174.142 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -63.21 -48.99 75.97 Favored 'General case' 0 CA--C 1.527 0.067 0 CA-C-N 120.206 1.366 . . . . 0.0 109.25 176.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -63.76 -55.57 22.14 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.037 -173.343 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -86.43 -36.08 19.31 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.995 0.918 . . . . 0.0 111.787 -169.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -131.95 60.04 48.73 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 123.756 0.822 . . . . 0.0 112.213 -169.233 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -59.54 157.42 31.89 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 122.122 1.881 . . . . 0.0 110.147 177.444 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 9.8 m 70.07 -37.06 0.37 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.308 1.443 . . . . 0.0 113.941 -177.68 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.8 tt -52.27 -40.44 61.76 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.53 1.059 . . . . 0.0 110.932 177.233 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.527 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -64.07 -14.29 53.48 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 176.864 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.0 tptt 64.4 -64.22 0.15 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 127.233 2.213 . . . . 0.0 113.145 -178.34 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -168.61 147.82 11.76 Favored Glycine 0 CA--C 1.525 0.683 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 179.751 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 53.7 ttm -32.7 -61.76 0.26 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 126.75 2.02 . . . . 0.0 113.463 -171.086 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.4 m -45.99 -41.09 11.35 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.177 1.391 . . . . 0.0 112.784 -177.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.9 m -55.41 -25.94 38.78 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.072 0.949 . . . . 0.0 111.441 -178.062 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.3 tp -52.29 -38.57 58.76 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 123.066 0.546 . . . . 0.0 110.403 176.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -57.21 -54.05 51.14 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.057 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -64.7 -55.61 18.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.002 -177.21 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tt -49.65 -56.09 11.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.623 1.169 . . . . 0.0 109.678 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.491 ' CE1' HG23 ' A' ' 61' ' ' VAL . 37.2 t80 -58.45 -46.45 86.54 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.197 -0.43 . . . . 0.0 110.76 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -58.68 -42.7 89.14 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.589 0.632 . . . . 0.0 111.316 -179.437 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -70.12 -50.16 43.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.685 0.755 . . . . 0.0 109.611 -177.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.45 -55.05 39.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.471 1.508 . . . . 0.0 109.603 -178.018 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.3 t0 -80.64 46.35 0.86 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.071 1.348 . . . . 0.0 112.245 -169.362 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -44.89 -41.32 7.04 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 126.68 1.992 . . . . 0.0 114.048 -171.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -103.21 -45.18 4.98 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 123.884 0.874 . . . . 0.0 110.822 -177.454 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -84.09 -4.98 88.0 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 117.829 -1.54 . . . . 0.0 114.166 -169.742 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.8 t0 -2.39 76.86 0.0 OUTLIER 'General case' 0 C--N 1.348 0.512 0 C-N-CA 129.018 2.927 . . . . 0.0 114.254 178.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 149.15 -47.56 0.63 Allowed Glycine 0 CA--C 1.525 0.682 0 N-CA-C 108.289 -1.924 . . . . 0.0 108.289 -169.328 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 -138.99 127.01 22.38 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.499 1.119 . . . . 0.0 110.14 179.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.491 HG23 ' CE1' ' A' ' 50' ' ' PHE . 32.9 t -88.48 117.82 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 124.746 1.218 . . . . 0.0 110.345 -177.438 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.2 m -80.89 155.77 26.37 Favored 'General case' 0 N--CA 1.461 0.118 0 C-N-CA 124.54 1.136 . . . . 0.0 110.849 172.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -55.54 -33.38 63.77 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 121.077 0.465 . . . . 0.0 112.091 -178.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.55 -47.5 69.96 Favored 'General case' 0 C--O 1.227 -0.092 0 O-C-N 121.592 -0.693 . . . . 0.0 110.714 172.26 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -72.79 -41.26 65.19 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -53.7 -43.92 69.37 Favored 'General case' 0 C--O 1.224 -0.274 0 O-C-N 121.981 -0.449 . . . . 0.0 110.494 177.827 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -57.4 -30.79 65.23 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.745 -0.597 . . . . 0.0 112.571 177.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.6 t -61.17 -39.83 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-N 119.245 0.93 . . . . 0.0 109.63 171.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.37 -46.87 84.52 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 172.312 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.7 t -54.83 -38.16 43.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 O-C-N 121.339 -0.851 . . . . 0.0 111.659 177.812 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -57.76 -39.23 76.93 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.687 -0.633 . . . . 0.0 110.575 173.403 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -71.95 -52.01 19.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.028 0.531 . . . . 0.0 110.471 177.484 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -53.81 -29.75 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.75 0.704 . . . . 0.0 110.574 176.09 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.8 m 77.62 42.98 0.11 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 127.157 2.183 . . . . 0.0 108.584 177.822 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.4 tp60 . . . . . 0 C--O 1.253 1.24 0 C-N-CA 125.857 1.663 . . . . 0.0 112.892 177.549 . . . . . . . . 0 0 . 1 stop_ save_