data_2nd0_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 2nd0 _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 7' ' ' CYS . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.839 0.352 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -75.77 147.09 80.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.653 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.5 146.8 96.71 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.4 2.734 . . . . 0.0 112.906 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.419 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.72 129.08 34.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.879 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.0 p -72.55 177.45 4.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 177.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -60.7 -46.74 89.22 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.014 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -54.19 -44.26 71.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.015 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -61.39 -46.77 88.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.464 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 10' ' ' MET . 90.7 mttt -62.41 -34.21 76.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.549 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.9 ttp85 -68.42 -40.96 81.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.973 0.416 . . . . 0.0 110.08 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.44 -49.08 79.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.022 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.769 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -63.19 -34.83 78.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.214 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.3 t -63.91 -34.18 77.38 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.048 0.452 . . . . 0.0 110.449 173.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.9 mt -79.26 -41.47 28.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.438 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.769 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.9 p30 -65.77 -42.91 90.24 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.143 178.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.431 ' HA ' HD12 ' A' ' 25' ' ' LEU . 45.1 mt -59.33 -37.32 68.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 177.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -71.34 -23.92 62.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.626 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 51.2 mtpt -83.45 -14.25 52.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.054 0.454 . . . . 0.0 110.281 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.463 HD13 HG11 ' A' ' 71' ' ' VAL . 92.2 mt -79.76 137.73 54.37 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.448 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 95.1 Cg_endo -80.98 172.55 12.92 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 123.183 2.589 . . . . 0.0 113.156 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.84 -44.64 49.34 Favored Glycine 0 CA--C 1.519 0.321 0 O-C-N 123.361 0.413 . . . . 0.0 113.701 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -50.16 -57.84 6.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.394 0.616 . . . . 0.0 111.175 -179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.635 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -74.17 -25.53 59.77 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.182 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.55 -26.89 68.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.124 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.44 93.34 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.208 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -76.61 -37.57 56.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.267 177.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.445 ' O ' HG13 ' A' ' 37' ' ' ILE . 57.4 t -59.09 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.619 177.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 15.0 p -63.43 -28.72 45.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.533 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -67.46 -42.17 83.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.216 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.69 -46.35 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 33' ' ' VAL . 57.1 mt -60.1 -55.63 22.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.44 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.439 HE21 ' HB2' ' A' ' 47' ' ' SER . 4.0 mt-30 -61.38 -40.98 96.32 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.5 t -74.28 -30.21 61.99 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.305 -0.247 . . . . 0.0 111.539 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.401 ' HD3' ' OE2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -82.3 -28.86 31.46 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.544 -0.463 . . . . 0.0 110.313 174.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -116.23 83.34 12.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.716 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.58 -16.01 52.07 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.41 2.074 . . . . 0.0 112.783 -178.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.2 t -74.01 -22.36 59.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 109.952 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.2 mt -96.42 25.98 4.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.395 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -63.12 -25.05 68.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -89.46 36.92 0.85 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.459 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.439 ' HB2' HE21 ' A' ' 38' ' ' GLN . 70.1 m -80.12 88.83 5.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 174.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -62.61 124.5 83.27 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.965 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -53.01 -23.09 20.5 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.463 2.775 . . . . 0.0 113.904 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.08 -23.37 48.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -147.66 72.62 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.259 0.224 . . . . 0.0 110.792 -174.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.0 mt -90.95 122.12 42.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.533 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -99.9 140.61 33.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.639 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.3 mt -112.54 107.69 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.51 92.66 4.14 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 122.23 1.014 . . . . 0.0 110.103 176.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -61.52 -15.93 42.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.229 -174.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -75.15 -22.32 58.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.495 -174.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -96.9 -26.72 14.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.0 mt -58.61 123.88 17.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.848 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.06 150.64 97.47 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.636 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -46.61 -29.5 7.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.483 2.122 . . . . 0.0 112.542 173.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 t -56.73 -55.36 35.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -63.77 -46.16 86.52 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.414 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -59.17 -37.2 76.77 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.093 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -73.25 -45.08 57.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.973 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.401 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 29.9 mt-10 -66.47 -38.29 87.0 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.679 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.464 ' O ' HG13 ' A' ' 71' ' ' VAL . 77.3 mt -60.36 -56.83 16.69 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.363 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -55.36 -41.83 73.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -58.43 -36.96 74.43 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.302 0.572 . . . . 0.0 110.534 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -82.77 -45.74 14.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.87 -175.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.464 HG13 ' O ' ' A' ' 67' ' ' LEU . 11.4 m -63.19 -36.01 74.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.04 0.448 . . . . 0.0 110.403 -177.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 30.6 p -71.75 -39.95 69.69 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.335 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -64.82 -21.56 66.81 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.611 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.635 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 29.3 t -91.14 -53.14 4.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.762 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.459 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.2 mt -79.51 -35.68 39.7 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -171.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 72' ' ' THR . 95.2 mtt180 -67.89 -31.43 71.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.4 tttp . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.033 177.381 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 4.4 t -100.81 149.87 5.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.13 -172.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -134.17 127.89 32.92 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -140.64 151.6 44.73 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.149 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.287 175.629 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.492 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 62.5 m . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 120.963 0.411 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.78 149.79 64.55 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.79 135.63 53.19 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 123.185 2.59 . . . . 0.0 112.42 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -70.04 135.02 48.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.5 p -76.76 176.18 8.71 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -61.86 -46.85 87.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.372 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -54.84 -44.66 74.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.112 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -64.7 -46.23 83.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.186 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -58.03 -44.24 87.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.179 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -63.86 -43.09 97.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.875 0.369 . . . . 0.0 110.275 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -57.62 -47.27 82.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.186 176.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 68' ' ' GLU . 0.7 OUTLIER -59.5 -48.07 83.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.036 179.172 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.631 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 59.7 p -60.87 -35.87 77.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.796 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.9 -35.93 67.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.954 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.51 ' O ' HD12 ' A' ' 75' ' ' LEU . 1.1 m-20 -70.05 -42.23 73.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.427 177.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.423 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.1 mt -56.72 -38.22 56.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.318 0.58 . . . . 0.0 110.646 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.1 -25.25 64.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.576 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -82.11 -15.75 52.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.057 0.456 . . . . 0.0 110.637 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 22' ' ' ILE . 92.1 mt -77.41 134.4 66.5 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.531 -176.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.462 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 92.1 Cg_endo -80.45 171.27 14.97 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 123.042 2.495 . . . . 0.0 113.252 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.3 -46.24 44.15 Favored Glycine 0 CA--C 1.52 0.365 0 O-C-N 123.377 0.423 . . . . 0.0 114.048 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -47.75 -51.99 20.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.09 0.471 . . . . 0.0 111.684 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.553 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -79.64 -30.13 41.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.088 -174.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.48 -27.07 68.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.52 -31.27 79.13 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.058 -0.591 . . . . 0.0 112.177 174.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.411 ' O ' HG13 ' A' ' 36' ' ' ILE . 17.1 tpp180 -81.69 -41.69 20.96 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.799 -0.236 . . . . 0.0 110.377 177.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 80.2 t -56.22 -54.12 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.84 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.1 -31.46 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.582 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.64 -41.68 92.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.867 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.2 mt -64.25 -50.98 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.107 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' VAL . 43.2 mt -56.24 -59.88 2.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.161 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -63.14 -34.4 77.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.8 m -77.69 -33.08 53.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 122.026 -0.421 . . . . 0.0 111.754 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -77.13 -30.12 55.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.093 0.473 . . . . 0.0 109.966 174.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 35.0 mm-40 -115.52 84.23 11.91 Favored Pre-proline 0 N--CA 1.446 -0.665 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.41 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.48 -13.97 40.89 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.398 2.066 . . . . 0.0 112.352 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.2 t -79.56 -11.15 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.134 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.0 mt -105.76 32.29 4.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.434 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -80.99 -1.76 45.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.235 0.54 . . . . 0.0 110.496 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -97.4 17.13 18.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.682 0.754 . . . . 0.0 109.659 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.9 m -75.86 95.74 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.903 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -54.82 122.9 43.31 Favored Pre-proline 0 C--N 1.331 -0.205 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 173.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.19 -16.88 23.41 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.889 2.393 . . . . 0.0 112.459 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -82.55 -36.79 25.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.247 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -131.92 62.02 1.64 Allowed 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.894 -176.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.503 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 24.0 mt -74.0 119.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.173 0.511 . . . . 0.0 111.458 -175.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -103.99 131.37 51.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.342 178.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 39.8 mt -106.87 109.67 28.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.27 101.92 11.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.101 0.953 . . . . 0.0 110.543 176.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.81 -6.9 44.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.312 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.74 -30.54 45.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.767 0.317 . . . . 0.0 110.765 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.5 p -90.16 -26.07 20.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.95 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.44 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 38.4 mt -59.32 127.38 31.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.637 176.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -72.91 148.17 89.21 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.854 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -43.79 -36.2 7.51 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.567 2.178 . . . . 0.0 113.201 175.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.491 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 33.5 t -54.6 -56.96 13.51 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 175.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -59.18 -47.8 83.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.456 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.5 mt -57.18 -40.37 77.21 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.115 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.492 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 18.3 tpt180 -71.1 -46.92 60.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.023 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 62' ' ' SER . 41.5 mt-10 -65.61 -38.64 90.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.408 . . . . 0.0 110.458 -177.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 71' ' ' VAL . 93.2 mt -62.0 -55.97 23.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.244 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.413 ' HB2' HD13 ' A' ' 18' ' ' LEU . 18.8 tt0 -53.83 -47.21 71.16 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.484 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 69' ' ' ARG . 35.2 ttp180 -52.7 -42.45 64.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.329 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -79.48 -47.84 14.93 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.832 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.1 m -63.79 -35.33 72.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.955 0.407 . . . . 0.0 110.381 -176.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 40.6 p -75.73 -36.69 59.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.828 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.3 p -66.56 -19.32 65.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.749 0.309 . . . . 0.0 110.601 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.553 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 24.4 t -90.44 -51.1 5.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.609 178.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.51 HD12 ' O ' ' A' ' 21' ' ' ASP . 81.3 mt -79.87 -36.8 36.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -173.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 72' ' ' THR . 46.1 mtp180 -79.18 -4.74 51.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.105 0.479 . . . . 0.0 110.711 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.0 tttm . . . . . 0 C--N 1.323 -0.568 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 172.585 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 44.3 mm . . . . . 0 C--O 1.231 0.131 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.631 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 88.8 t -104.88 122.91 58.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.419 -177.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 16.5 ttmm -107.09 117.34 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.507 171.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -127.79 141.88 51.46 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp . . . . . 0 C--N 1.316 -0.879 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.695 -179.349 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 120.795 0.331 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.03 154.33 60.55 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.609 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.59 128.92 24.77 Favored 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 123.172 2.581 . . . . 0.0 112.14 -176.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.449 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -61.34 130.06 44.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.189 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.8 p -73.65 173.88 9.13 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.75 -47.3 86.23 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.725 -174.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -53.7 -41.95 67.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.489 . . . . 0.0 111.081 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -67.56 -46.96 71.19 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.121 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.449 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.3 mttt -58.73 -42.22 88.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.259 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -62.0 -44.41 96.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.909 0.385 . . . . 0.0 110.336 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.99 -41.41 78.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.426 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.834 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 1.5 mt -67.0 -36.04 81.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.859 -176.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.4 p -65.74 -29.13 69.61 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.867 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.22 -42.41 31.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.834 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.4 p30 -67.85 -45.67 73.94 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.196 -0.201 . . . . 0.0 110.974 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' LEU . 36.0 mt -57.25 -34.21 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.365 0.603 . . . . 0.0 110.17 177.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -71.39 -29.37 64.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.434 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 55.4 mtpt -78.92 -22.37 45.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.035 0.445 . . . . 0.0 110.568 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.485 HD22 ' HG ' ' A' ' 75' ' ' LEU . 86.6 mt -72.51 138.76 80.79 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.521 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 48.9 Cg_endo -83.81 172.63 9.85 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.475 2.783 . . . . 0.0 112.799 178.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.03 -44.38 62.32 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.548 -0.358 . . . . 0.0 113.466 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.3 mp0 -46.52 -52.06 14.14 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.615 0.721 . . . . 0.0 111.31 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.557 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.2 mptp? -83.51 -25.7 30.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.816 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.07 -27.08 68.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.311 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.78 92.08 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.046 -0.597 . . . . 0.0 111.625 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -76.74 -42.86 39.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.561 0.22 . . . . 0.0 110.72 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.445 HG11 HD22 ' A' ' 67' ' ' LEU . 59.9 t -56.12 -52.07 54.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.961 0.41 . . . . 0.0 110.731 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.435 ' CG2' HD11 ' A' ' 52' ' ' ILE . 8.0 p -65.14 -32.25 57.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.625 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -63.61 -42.43 98.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 79.3 mt -62.79 -49.06 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.316 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.405 HG23 HD22 ' A' ' 59' ' ' LEU . 51.1 mt -61.51 -56.97 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -61.51 -32.97 73.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.9 t -80.16 -37.2 33.89 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.219 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.566 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -72.8 -35.6 67.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 120.972 0.415 . . . . 0.0 110.172 175.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.514 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 25.4 mm-40 -114.12 84.63 9.26 Favored Pre-proline 0 N--CA 1.442 -0.833 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.969 -175.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.2 -13.31 39.32 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.334 2.023 . . . . 0.0 112.33 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.0 m -79.06 -7.2 57.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.238 0.542 . . . . 0.0 110.353 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -110.88 25.62 11.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.32 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.77 -16.13 60.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.912 0.387 . . . . 0.0 110.844 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.72 28.14 1.6 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.86 0.362 . . . . 0.0 111.061 177.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 p -80.05 97.71 6.93 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -57.3 123.93 63.79 Favored Pre-proline 0 CA--C 1.516 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.95 -21.23 25.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 123.075 2.517 . . . . 0.0 113.15 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.61 -22.08 37.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.06 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -143.64 75.41 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.307 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.435 HD11 ' CG2' ' A' ' 34' ' ' VAL . 28.9 mt -92.05 121.81 42.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.648 0.261 . . . . 0.0 111.091 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -104.21 137.34 42.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.737 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 54.2 mt -110.83 109.98 30.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.632 0.253 . . . . 0.0 110.58 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -110.53 98.78 7.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.933 0.873 . . . . 0.0 110.474 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -64.66 -16.36 62.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.582 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -74.16 -27.51 60.87 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.659 -176.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.08 -26.63 17.38 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.921 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.405 HD22 HG23 ' A' ' 37' ' ' ILE . 29.8 mt -56.53 128.64 37.19 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.238 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.514 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 24.0 mttm -70.84 149.23 95.05 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.822 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -46.46 -38.84 21.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.16 1.907 . . . . 0.0 112.35 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.8 m -56.61 -50.45 71.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.992 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.3 m -62.14 -48.22 81.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.395 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.02 -34.96 70.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -73.76 -50.54 20.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.128 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.566 ' OE1' ' HD3' ' A' ' 40' ' ' ARG . 40.9 mt-10 -62.41 -40.76 97.59 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.712 0.292 . . . . 0.0 110.779 -178.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.2 mt -57.1 -60.35 3.73 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.357 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.568 ' OE2' HG21 ' A' ' 72' ' ' THR . 6.1 tp10 -51.92 -52.35 50.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.346 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -55.9 -36.5 67.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.051 0.453 . . . . 0.0 110.941 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.13 -48.19 18.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.845 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.476 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -63.55 -36.19 75.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.825 0.345 . . . . 0.0 110.62 -175.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.568 HG21 ' OE2' ' A' ' 68' ' ' GLU . 0.9 OUTLIER -67.74 -39.26 84.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.1 p -65.62 -23.15 66.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.812 0.339 . . . . 0.0 110.573 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.557 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 49.1 t -90.01 -47.11 8.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.973 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.485 ' HG ' HD22 ' A' ' 25' ' ' LEU . 74.8 mt -87.8 -44.17 11.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' THR . 90.4 mtt180 -66.83 -26.03 66.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.803 0.335 . . . . 0.0 111.208 -176.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.7 mttp . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.17 178.904 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . 0.453 HD11 ' N ' ' B' ' 204' ' ' ILE . 2.3 mp . . . . . 0 C--O 1.235 0.333 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.33 163.24 2.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.158 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' B' ' 206' ' ' LYS . 0.0 OUTLIER -159.24 141.85 14.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.114 169.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -140.93 159.62 41.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.896 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.846 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.8 m . . . . . 0 C--O 1.234 0.28 0 CA-C-O 121.201 0.524 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.12 145.46 99.0 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.916 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -64.75 152.63 81.32 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.901 2.4 . . . . 0.0 112.066 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.3 mmt -85.86 130.51 34.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.519 -178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.41 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 39.9 p -77.8 178.2 7.57 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 175.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.29 -49.59 77.27 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.728 -174.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.13 -49.63 63.33 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 109.711 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.41 -44.93 96.29 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.842 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 11' ' ' SER . 89.7 mttt -60.38 -41.81 94.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.402 177.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -64.73 -41.54 95.88 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.826 0.346 . . . . 0.0 110.396 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.49 -47.56 81.58 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.546 HD22 ' OD1' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -61.91 -41.06 97.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.731 178.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.9 p -63.81 -25.32 68.12 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.211 -0.93 . . . . 0.0 110.449 176.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.9 mt -84.73 -42.99 14.71 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.448 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.546 ' OD1' HD22 ' A' ' 18' ' ' LEU . 1.1 p30 -67.4 -41.36 85.06 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 121.258 -0.177 . . . . 0.0 110.785 177.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -58.43 -40.57 78.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.015 0.436 . . . . 0.0 110.269 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -68.34 -30.92 69.99 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -62.07 -35.37 78.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.978 0.418 . . . . 0.0 111.346 173.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.529 ' CD1' HG11 ' A' ' 71' ' ' VAL . 95.0 mt -68.35 135.79 91.06 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.549 -0.751 . . . . 0.0 112.313 -172.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.44 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.2 Cg_endo -80.83 172.09 13.59 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.342 2.695 . . . . 0.0 112.803 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.52 -43.46 52.69 Favored Glycine 0 C--O 1.237 0.332 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.378 -175.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -48.62 -55.87 10.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.522 0.677 . . . . 0.0 111.148 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.578 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -80.37 -27.06 38.3 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.445 -174.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.564 ' O ' HG21 ' A' ' 34' ' ' VAL . 11.0 mt -62.64 -27.75 69.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.626 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.574 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 36' ' ' ILE . 12.6 tpp180 -66.24 -41.52 89.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.671 0.272 . . . . 0.0 110.675 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.507 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.7 t -56.85 -52.14 58.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.88 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' ' 30' ' ' LEU . 22.2 t -64.17 -36.84 78.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.455 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -59.45 -41.63 90.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.206 177.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.1 mt -66.73 -48.69 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.24 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 33' ' ' VAL . 55.0 mt -58.88 -55.83 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.036 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -62.3 -34.1 75.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.3 t -78.28 -36.13 47.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -176.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.605 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 5.9 mpt_? -80.32 -27.88 38.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.424 177.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.63 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 60.0 mm-40 -114.21 87.05 12.66 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.851 178.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.12 -13.1 35.79 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.125 1.883 . . . . 0.0 112.109 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.9 t -72.7 -20.95 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.232 0.539 . . . . 0.0 109.803 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.1 mt -104.1 33.82 3.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.228 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -72.74 -17.65 61.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.505 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.71 41.86 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.778 0.799 . . . . 0.0 110.062 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.9 m -88.51 91.01 8.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.424 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -60.04 123.22 71.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.19 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_exo -56.24 -19.04 26.09 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.253 2.635 . . . . 0.0 113.147 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.19 -27.82 38.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -146.85 78.67 1.5 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.921 -176.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.466 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 23.2 mt -92.25 125.74 44.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.205 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -104.55 119.63 39.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.651 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.415 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 48.2 mt -96.87 109.42 23.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.238 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.401 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 17.0 p-10 -109.39 98.62 7.99 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.931 0.872 . . . . 0.0 110.078 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -68.89 -0.35 5.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.802 -175.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -85.6 -24.69 27.06 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.95 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.2 p -101.78 -26.01 13.62 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.457 HD23 ' HG3' ' A' ' 41' ' ' GLU . 31.3 mt -53.8 128.78 31.2 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.647 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.63 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 23.1 mttm -71.91 150.99 92.97 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.657 178.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -47.11 -36.5 21.43 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.296 1.997 . . . . 0.0 112.426 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.43 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 25.6 t -54.4 -54.43 40.73 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.0 -49.62 76.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.668 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -57.38 -37.64 72.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.306 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.6 -45.97 23.55 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.085 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.7 mt-10 -63.92 -36.66 84.67 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.789 0.328 . . . . 0.0 110.457 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.432 HD22 HG11 ' A' ' 33' ' ' VAL . 83.6 mt -62.2 -56.1 22.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.116 174.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 71' ' ' VAL . 30.0 tt0 -55.16 -46.83 75.76 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.144 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -63.03 -31.93 73.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.795 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.412 ' HH ' ' CB ' ' A' ' 29' ' ' LYS . 68.0 t80 -78.53 -47.78 16.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.529 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.7 m -63.12 -42.47 96.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.14 0.495 . . . . 0.0 110.471 -176.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.426 ' H ' HG22 ' A' ' 71' ' ' VAL . 24.7 p -63.91 -36.66 84.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.933 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 82.9 p -67.73 -24.23 65.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.578 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.3 t -91.14 -32.35 15.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.433 -177.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 21' ' ' ASP . 28.1 mt -97.79 -43.05 7.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -71.46 -10.7 60.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 110.377 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.283 176.284 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 4.0 mp . . . . . 0 CA--C 1.521 -0.16 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.415 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 26.9 t -104.9 105.31 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.337 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.2 ttmm -96.01 118.02 31.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.429 ' CZ ' HD21 ' A' ' 30' ' ' LEU . 10.3 p90 -131.75 137.32 48.15 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.67 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 59.0 mttm . . . . . 0 C--N 1.317 -0.808 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.438 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 m . . . . . 0 N--CA 1.454 -0.253 0 CA-C-O 120.942 0.401 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -75.94 145.19 77.25 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.584 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.9 124.34 13.41 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.494 2.129 . . . . 0.0 110.962 176.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.491 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.2 mmt -57.6 128.7 38.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 p -73.07 175.61 6.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.892 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.311 -174.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -56.3 -40.18 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.158 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.11 -46.4 81.16 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.719 178.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.491 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.0 mttt -60.98 -39.56 90.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.394 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -64.2 -44.74 91.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.38 -44.24 88.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.822 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.93 -39.89 79.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.819 -176.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.471 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 87.5 p -63.48 -25.77 68.41 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.715 -0.615 . . . . 0.0 110.328 175.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.548 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.2 mt -82.69 -44.76 15.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.164 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.822 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.6 p30 -62.09 -41.19 97.94 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.409 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.465 ' HA ' HD12 ' A' ' 25' ' ' LEU . 84.6 mt -62.94 -40.11 87.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.907 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -68.42 -28.5 67.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.962 0.411 . . . . 0.0 111.213 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.5 mtpp -78.25 -16.88 57.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 84.5 mt -79.3 132.56 62.35 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.619 -176.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 78.3 Cg_endo -76.69 172.18 16.68 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 123.199 2.599 . . . . 0.0 113.085 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.03 -45.54 50.98 Favored Glycine 0 C--N 1.334 0.442 0 O-C-N 123.301 0.376 . . . . 0.0 113.927 -172.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -49.79 -55.31 14.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.415 0.626 . . . . 0.0 110.993 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.584 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.9 mptp? -76.5 -31.43 57.71 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.944 -174.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mt -58.39 -31.05 67.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.489 175.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.25 -34.53 89.48 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.268 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -79.03 -39.91 32.79 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.584 0.23 . . . . 0.0 110.499 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.3 t -56.18 -55.09 20.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.685 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.63 -30.77 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.638 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -65.26 -41.77 93.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.908 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.8 mt -65.99 -41.22 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.903 177.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.486 HG23 HD22 ' A' ' 59' ' ' LEU . 72.8 mt -62.41 -60.56 2.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.218 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -65.83 -29.67 70.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -78.28 -38.79 41.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.05 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.447 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 9.6 mpt_? -76.4 -31.92 58.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.577 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.627 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 49.4 mm-40 -112.72 85.26 7.35 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.441 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.76 -12.26 30.71 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.363 2.042 . . . . 0.0 112.567 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -82.29 -5.27 58.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 0.0 110.574 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.5 mt -115.63 27.42 9.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.02 177.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -80.3 -17.14 52.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.252 0.549 . . . . 0.0 110.476 -174.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -92.85 20.66 6.34 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.807 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 66.8 m -68.78 105.26 2.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.177 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.648 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -50.6 120.86 13.57 Favored Pre-proline 0 N--CA 1.463 0.187 0 O-C-N 123.118 0.262 . . . . 0.0 110.534 171.576 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.08 -23.08 67.25 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.787 2.325 . . . . 0.0 111.556 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.477 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 21.9 m-20 -71.77 -35.96 70.21 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.643 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.648 ' HB2' ' OD1' ' A' ' 48' ' ' ASN . 20.5 mm-40 -138.64 72.1 1.4 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.035 0.379 . . . . 0.0 111.041 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mt -82.79 120.7 34.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.009 0.433 . . . . 0.0 111.136 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.506 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 19.0 mm-40 -100.84 122.69 43.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.053 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.422 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.5 mt -91.04 108.76 20.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.952 175.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -107.19 98.85 8.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.163 0.982 . . . . 0.0 110.309 177.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -70.67 -1.04 10.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.137 -174.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -84.35 -29.28 26.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.932 0.396 . . . . 0.0 110.765 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.6 p -90.7 -32.21 16.27 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.486 HD22 HG23 ' A' ' 37' ' ' ILE . 33.3 mt -53.18 126.98 22.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.118 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.627 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 27.5 mttm -66.03 147.58 98.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.5 -30.44 21.19 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.362 2.042 . . . . 0.0 111.762 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 13.6 m -60.51 -52.23 66.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 174.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -61.13 -46.46 90.47 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.461 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.87 -39.18 80.62 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.843 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -68.23 -48.24 65.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.075 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 62' ' ' SER . 17.3 mm-40 -66.48 -40.72 89.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.853 -178.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.436 HD22 HG11 ' A' ' 33' ' ' VAL . 75.6 mt -57.15 -55.39 35.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.682 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -54.08 -42.4 69.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.91 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -59.86 -43.03 94.92 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.326 0.584 . . . . 0.0 110.167 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -74.88 -46.55 35.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.969 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.456 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.2 m -63.9 -38.1 81.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.074 0.464 . . . . 0.0 110.727 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.46 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.7 p -72.8 -38.44 67.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.056 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.2 p -64.84 -19.57 65.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.584 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 31.4 t -90.84 -54.83 3.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.65 177.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.467 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.2 mt -78.85 -27.46 44.16 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 72' ' ' THR . 57.1 mtp180 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.621 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 tttt . . . . . 0 C--N 1.324 -0.512 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 172.773 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 10.6 pt . . . . . 0 C--O 1.234 0.273 0 CA-C-O 120.931 0.396 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.471 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 61.3 t -121.12 113.82 41.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.633 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.506 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 19.5 ttmm -92.67 116.65 29.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -129.57 143.31 50.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.245 0.545 . . . . 0.0 110.55 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 44.1 mttp . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.355 176.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.7 m . . . . . 0 C--O 1.236 0.352 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.56 144.41 97.69 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 170.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.9 129.57 21.12 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.78 2.32 . . . . 0.0 110.993 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.537 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -64.67 128.14 34.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.567 -177.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.4 p -73.53 174.45 8.23 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.7 -46.7 88.28 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.475 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.84 -44.23 77.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.368 . . . . 0.0 111.042 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -63.32 -46.09 88.29 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.913 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.537 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.6 mttt -61.25 -39.26 89.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.497 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.8 ttp180 -62.91 -43.62 98.29 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -56.75 -46.13 81.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.167 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.556 HD22 ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -65.65 -33.17 75.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.464 -175.116 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.4 p -70.1 -27.16 64.37 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.51 -0.744 . . . . 0.0 109.986 175.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 85.8 mt -80.91 -46.01 15.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.201 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.556 ' OD1' HD22 ' A' ' 18' ' ' LEU . 1.3 p30 -65.44 -42.27 92.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.21 -0.196 . . . . 0.0 111.302 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.427 ' HA ' HD12 ' A' ' 25' ' ' LEU . 35.1 mt -60.37 -41.5 87.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.016 0.436 . . . . 0.0 110.493 176.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -65.14 -24.12 67.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.585 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.6 mtpp -85.89 -7.63 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.453 ' CD1' HG11 ' A' ' 71' ' ' VAL . 80.4 mt -86.23 137.67 34.78 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.571 -177.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -80.32 167.31 19.56 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.259 2.639 . . . . 0.0 112.841 177.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.01 -46.1 41.72 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 114.39 0.516 . . . . 0.0 114.39 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -53.67 -51.28 63.69 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.451 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.745 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -73.19 -32.73 64.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.642 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.579 HD21 ' CD1' ' B' ' 207' ' ' PHE . 10.6 tp -62.59 -24.63 67.66 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.65 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.87 99.51 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.909 -0.662 . . . . 0.0 111.493 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.545 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.1 tpm_? -67.85 -40.99 83.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.2 t -59.0 -58.15 8.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.008 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.13 -27.65 42.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.796 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -68.29 -41.96 80.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.301 -0.409 . . . . 0.0 109.964 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.545 HG13 ' HE ' ' A' ' 32' ' ' ARG . 61.8 mt -62.11 -43.47 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 120.974 0.416 . . . . 0.0 110.31 177.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 33' ' ' VAL . 53.2 mt -65.02 -58.5 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.402 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -63.07 -28.47 70.11 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -173.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -89.95 -27.74 19.61 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.489 -0.484 . . . . 0.0 112.123 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -81.89 -22.94 36.59 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.355 171.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -125.0 65.12 46.39 Favored Pre-proline 0 N--CA 1.442 -0.867 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.936 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -52.47 -17.93 7.4 Favored 'Trans proline' 0 N--CA 1.478 0.601 0 C-N-CA 122.971 2.447 . . . . 0.0 113.284 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.4 m -66.3 -21.85 66.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.963 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.59 41.95 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.036 0.446 . . . . 0.0 110.306 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -73.56 -15.55 61.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.154 -174.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -96.52 35.1 1.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.875 0.369 . . . . 0.0 111.213 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.2 m -81.33 89.38 6.08 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 86.3 m-20 -61.35 123.44 76.23 Favored Pre-proline 0 CA--C 1.52 -0.209 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.126 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 71.1 Cg_exo -53.17 -21.74 17.68 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.654 2.903 . . . . 0.0 114.268 -174.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.488 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 4.6 p-10 -76.11 -36.3 58.92 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.875 -177.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -143.7 77.5 1.56 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 26.2 mt -85.84 128.42 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.214 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -101.15 117.87 35.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 52.8 mt -90.38 108.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.52 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.2 t70 -105.11 99.15 8.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -68.18 -13.37 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.547 -172.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -79.38 -35.26 41.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.789 0.328 . . . . 0.0 110.559 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.4 p -80.91 -21.89 40.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.994 176.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 25.0 mt -67.16 135.62 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.494 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -76.54 147.45 78.64 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.005 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -42.94 -40.46 8.45 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.929 2.42 . . . . 0.0 113.05 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -58.13 -50.22 74.25 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.036 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -47.91 83.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.263 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.82 -37.56 71.37 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.023 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -70.63 -52.11 23.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.174 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -62.99 -39.34 94.44 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 111.059 -177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.422 HD22 HG11 ' A' ' 33' ' ' VAL . 85.9 mt -60.24 -57.97 10.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.682 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 71' ' ' VAL . 7.9 tt0 -58.77 -45.79 88.99 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.726 0.298 . . . . 0.0 111.155 -178.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -57.67 -30.15 65.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.259 0.552 . . . . 0.0 110.295 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 65.1 t80 -82.88 -49.2 9.91 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.919 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 68' ' ' GLU . 16.0 m -60.81 -36.18 69.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.239 0.543 . . . . 0.0 110.482 -176.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 22.3 p -69.95 -39.91 75.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 92.4 p -65.63 -20.07 66.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.795 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.745 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.5 t -90.76 -53.49 4.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.762 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.443 ' HG ' HD22 ' A' ' 25' ' ' LEU . 71.1 mt -77.28 -36.0 54.66 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -172.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 72' ' ' THR . 98.3 mtt180 -75.33 -7.62 54.46 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.249 0.547 . . . . 0.0 110.472 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 57.7 tttp . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.166 176.358 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . 0.457 HD12 ' HA ' ' A' ' 55' ' ' ASP . 39.3 mm . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.954 0.407 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 58.2 t -85.27 117.73 30.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.328 -174.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -105.63 77.95 1.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.605 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.579 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.0 p90 -92.01 158.16 16.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.217 0.532 . . . . 0.0 110.478 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 12.4 mptt . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.624 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.7 m . . . . . 0 N--CA 1.45 -0.433 0 CA-C-O 120.903 0.382 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -75.75 144.78 77.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.34 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.51 135.93 51.97 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.847 2.365 . . . . 0.0 111.534 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.426 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -72.66 131.29 42.22 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.826 -175.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 p -76.06 176.71 7.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.782 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.33 -47.88 84.12 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.597 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -53.09 -47.61 68.42 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.399 0.618 . . . . 0.0 110.024 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -63.86 -45.03 91.29 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.963 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 10' ' ' MET . 96.2 mttt -59.2 -44.6 92.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.396 175.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 50.0 ttp85 -59.48 -47.62 84.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.163 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -58.85 -51.94 67.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.968 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.68 -49.82 67.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.827 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.41 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 93.5 p -62.57 -30.81 71.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.918 0.389 . . . . 0.0 111.076 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 94.0 mt -73.55 -41.98 62.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.798 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 23.0 m-20 -67.26 -41.51 85.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.291 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.437 ' HA ' HD12 ' A' ' 25' ' ' LEU . 95.6 mt -58.1 -41.83 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -66.65 -27.59 67.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.532 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.92 -24.82 43.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.061 0.458 . . . . 0.0 110.451 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 22' ' ' ILE . 93.1 mt -66.67 135.49 94.46 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.398 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.483 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.8 Cg_endo -80.49 170.08 16.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.951 2.434 . . . . 0.0 112.858 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.59 -44.0 46.35 Favored Glycine 0 CA--C 1.519 0.329 0 O-C-N 123.195 0.309 . . . . 0.0 113.327 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 1.3 mp0 -45.43 -54.09 7.83 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.5 0.667 . . . . 0.0 111.203 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.654 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -82.71 -29.42 29.84 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.91 -175.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.74 -27.64 68.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.443 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.3 -28.85 71.6 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.139 174.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' O ' HG13 ' A' ' 36' ' ' ILE . 14.5 tpp180 -84.31 -43.04 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 122.585 -0.362 . . . . 0.0 110.335 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 37' ' ' ILE . 43.4 t -55.07 -54.16 26.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.4 HG21 HD11 ' A' ' 52' ' ' ILE . 9.2 p -65.49 -29.86 48.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.526 -178.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -66.01 -39.86 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.638 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.5 mt -66.93 -49.97 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.949 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 33' ' ' VAL . 50.0 mt -56.95 -59.73 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.089 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -62.48 -32.46 73.36 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.9 t -80.24 -32.57 38.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -82.58 -25.13 33.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 121.92 -0.488 . . . . 0.0 110.21 175.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.454 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.8 mm-40 -117.58 82.08 15.31 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.523 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.11 -15.11 45.91 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.584 2.189 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.9 t -78.31 -24.26 46.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 109.761 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.55 17.94 5.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.199 0.523 . . . . 0.0 110.22 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HB3' ' HZ1' ' A' ' 45' ' ' LYS . 8.1 ttpm? -74.0 -10.73 59.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.476 0.655 . . . . 0.0 109.683 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -84.22 4.93 28.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.257 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.0 m -67.48 97.84 0.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.299 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -60.34 122.81 69.93 Favored Pre-proline 0 N--CA 1.452 -0.354 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_exo -52.09 -26.03 24.6 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.664 2.909 . . . . 0.0 113.451 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -71.01 -29.68 65.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.186 -177.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -143.65 76.07 1.5 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.944 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.4 HD11 HG21 ' A' ' 34' ' ' VAL . 22.7 mt -88.4 126.91 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -178.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -108.1 132.55 53.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.775 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.0 mt -104.02 108.84 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 174.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -110.87 97.27 6.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.923 0.868 . . . . 0.0 110.601 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -68.12 -9.27 45.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.937 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -21.4 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.472 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.5 p -99.02 -25.24 14.62 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.454 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 23.3 mt -57.9 130.42 46.45 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.388 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -74.32 148.18 85.89 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.93 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -48.1 -33.93 22.31 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.75 2.3 . . . . 0.0 112.398 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.6 m -57.82 -53.32 59.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.46 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -62.33 -48.45 79.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.739 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.24 -36.68 71.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -69.44 -50.24 47.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.816 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.35 -38.94 91.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.529 ' O ' HG13 ' A' ' 71' ' ' VAL . 85.1 mt -61.22 -56.03 25.26 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.342 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -55.14 -49.77 70.96 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.802 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -55.68 -38.34 69.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.674 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -75.85 -50.08 16.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.726 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.529 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -62.82 -35.79 72.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 -175.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.7 p -74.61 -38.46 62.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.663 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.6 p -64.99 -19.43 65.99 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.559 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.654 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.4 t -91.02 -55.02 3.71 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.74 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.418 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.1 mt -74.28 -34.5 63.57 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -174.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' A' ' 72' ' ' THR . 28.2 mtp180 -80.07 8.77 6.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.276 0.56 . . . . 0.0 110.226 177.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.9 tttt . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.856 171.776 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 19.8 mm . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 121.403 0.62 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 39.6 t -82.36 133.93 28.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.842 -175.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -116.65 119.9 36.97 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -129.86 137.88 50.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.155 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 68.3 mttm . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.952 -179.679 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.3 m . . . . . 0 C--O 1.237 0.398 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -72.36 144.32 86.64 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.046 173.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -66.36 124.23 12.22 Favored 'Trans proline' 0 C--O 1.236 0.383 0 C-N-CA 122.801 2.334 . . . . 0.0 111.667 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -58.75 125.76 24.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.904 -176.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 p -72.49 175.22 6.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.15 -49.24 78.63 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.874 0.306 . . . . 0.0 110.356 -175.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -55.12 -41.74 72.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.08 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.85 -46.02 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.938 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.67 -42.89 89.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.416 176.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -63.95 -43.5 95.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.298 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -58.85 -43.06 90.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.369 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.681 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -65.64 -38.4 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.275 -177.44 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.8 p -64.55 -28.13 69.43 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 119.979 -0.689 . . . . 0.0 110.093 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.59 -41.21 19.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.459 -178.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.681 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -67.47 -40.87 85.32 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.682 177.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' HD12 ' A' ' 25' ' ' LEU . 79.7 mt -58.78 -40.07 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.093 0.473 . . . . 0.0 110.197 175.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -69.87 -29.4 66.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.824 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -64.13 -34.18 77.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.247 0.546 . . . . 0.0 110.966 173.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.53 ' CD1' HG11 ' A' ' 71' ' ' VAL . 95.4 mt -69.26 131.0 90.61 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.214 -172.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -77.54 172.9 15.04 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 123.525 2.817 . . . . 0.0 112.431 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.33 -45.94 52.38 Favored Glycine 0 CA--C 1.518 0.266 0 O-C-N 123.324 0.39 . . . . 0.0 113.846 -172.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 9.0 mp0 -47.26 -52.47 15.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.643 0.735 . . . . 0.0 111.034 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.578 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 2.1 mptp? -78.36 -23.8 46.72 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.155 -173.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.11 -27.37 68.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.124 177.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.29 -35.99 92.41 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.067 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.454 ' O ' HG13 ' A' ' 36' ' ' ILE . 15.5 tpp180 -78.92 -40.83 31.08 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.199 -0.201 . . . . 0.0 110.698 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.5 t -57.3 -53.62 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.59 -30.71 51.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.963 0.411 . . . . 0.0 110.357 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -65.89 -40.98 92.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.962 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 32' ' ' ARG . 64.8 mt -65.85 -50.89 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.975 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.8 mt -58.56 -58.59 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 -178.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -61.01 -32.53 72.12 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.7 t -79.62 -38.68 33.29 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -176.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -75.6 -27.83 58.67 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.074 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.6 mm-40 -115.78 84.16 12.53 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.122 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.82 -12.83 36.08 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.363 2.042 . . . . 0.0 111.966 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.4 m -79.76 -8.62 59.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.375 177.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.6 mt -113.1 26.96 10.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.09 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -69.69 -23.39 63.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.403 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.69 21.43 1.53 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.024 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.0 m -75.1 91.08 2.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.83 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -53.0 125.86 41.63 Favored Pre-proline 0 CA--C 1.52 -0.211 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.998 173.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.27 -15.18 17.74 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.836 2.357 . . . . 0.0 112.159 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.512 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 16.7 m-20 -85.2 -29.79 24.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.555 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -139.6 59.68 1.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.697 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 18.9 mt -69.64 125.0 26.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.083 0.468 . . . . 0.0 111.508 -175.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -104.93 126.33 51.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.616 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 60.2 mt -107.28 108.3 24.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 173.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.5 p-10 -110.53 103.6 12.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.83 0.824 . . . . 0.0 110.762 176.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -69.68 -12.28 61.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.556 -174.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -74.56 -27.68 60.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.458 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.1 p -95.54 -28.03 15.07 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.097 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.6 mt -56.62 127.1 29.7 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 177.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -71.46 146.95 92.27 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -43.5 -32.85 3.92 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.864 2.376 . . . . 0.0 113.004 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.46 -54.72 43.87 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.686 0.279 . . . . 0.0 110.645 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -60.88 -47.73 85.03 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.234 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.3 mt -55.74 -39.87 71.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.92 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.3 tpt180 -70.47 -49.25 50.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.244 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -63.8 -36.56 84.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.775 0.321 . . . . 0.0 110.632 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.464 ' O ' HG13 ' A' ' 71' ' ' VAL . 84.8 mt -60.82 -56.46 20.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.998 174.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -54.48 -43.03 71.4 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.99 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -60.16 -39.29 85.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.375 0.607 . . . . 0.0 110.35 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -75.85 -47.07 27.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.775 -176.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.53 HG11 ' CD1' ' A' ' 25' ' ' LEU . 11.7 m -64.08 -42.71 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.07 0.462 . . . . 0.0 110.641 -175.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 25.3 p -67.69 -32.29 72.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.491 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.7 t -66.15 -25.32 66.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.263 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.578 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.7 t -91.72 -45.37 8.47 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.977 0.418 . . . . 0.0 110.414 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 21' ' ' ASP . 26.7 mt -85.51 -28.5 24.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -169.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 72' ' ' THR . 30.7 mtp180 -80.43 8.8 6.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.476 0.655 . . . . 0.0 110.116 177.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.9 tttp . . . . . 0 N--CA 1.449 -0.483 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.077 170.486 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 58.3 mt . . . . . 0 C--O 1.235 0.323 0 CA-C-O 121.14 0.495 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 47.3 t -92.91 108.03 19.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.62 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 4.4 ttmp? -104.28 109.8 21.77 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.135 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -126.84 151.1 48.8 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.044 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 67.6 mttm . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.6 m . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 120.922 0.391 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -68.27 144.17 96.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.26 149.72 88.23 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.843 2.362 . . . . 0.0 112.075 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -85.95 119.89 26.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 p -67.6 174.64 3.35 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -46.95 84.29 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.762 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -51.26 -48.7 62.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.682 0.753 . . . . 0.0 109.943 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -65.15 -46.06 82.47 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.062 -175.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.03 -38.98 73.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.268 176.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -62.76 -44.37 96.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.327 175.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -59.74 -43.47 94.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.502 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.768 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -66.42 -38.06 86.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.305 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.7 p -65.37 -26.8 68.17 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.628 -0.67 . . . . 0.0 110.359 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.86 -43.87 19.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.396 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.768 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -64.09 -43.8 94.26 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.775 178.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.9 mt -59.21 -41.96 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.931 0.396 . . . . 0.0 110.724 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -70.25 -27.44 64.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -74.5 -33.97 62.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.491 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.506 HD13 HG11 ' A' ' 71' ' ' VAL . 77.9 mt -56.94 138.19 79.13 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.333 -175.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.604 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 59.0 Cg_endo -79.22 163.24 25.22 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 123.521 2.814 . . . . 0.0 111.583 178.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.31 -27.15 60.13 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.151 -0.931 . . . . 0.0 114.855 -169.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' OE2' ' HB2' ' A' ' 26' ' ' PRO . 1.4 mp0 -63.07 -54.47 37.46 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.594 0.697 . . . . 0.0 109.711 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.604 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 3.8 mptt -72.22 -26.7 62.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.902 -176.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.02 -25.7 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.014 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.26 -33.57 86.46 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.944 174.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.437 ' O ' HG13 ' A' ' 36' ' ' ILE . 9.0 tpp180 -79.96 -41.99 24.86 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 122.752 -0.264 . . . . 0.0 110.37 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -56.36 -52.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.472 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.83 -31.24 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.477 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -66.18 -42.14 89.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.998 176.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.1 mt -65.93 -51.4 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.6 mt -57.72 -59.31 3.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.779 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.409 ' OE1' ' HA ' ' A' ' 45' ' ' LYS . 9.9 mt-30 -61.93 -33.74 74.81 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -76.56 -36.28 57.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.592 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -78.47 -31.24 47.79 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.075 0.464 . . . . 0.0 110.024 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 16.5 mm-40 -116.33 83.26 12.8 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.105 -177.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.89 -15.13 48.84 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.389 2.059 . . . . 0.0 112.456 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -74.52 -19.75 60.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.987 0.422 . . . . 0.0 110.199 177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -95.5 19.01 11.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HA ' ' OE1' ' A' ' 38' ' ' GLN . 55.1 tttm -69.98 -9.12 54.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.275 0.56 . . . . 0.0 110.598 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -87.14 11.0 15.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.916 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.5 m -72.81 91.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -62.96 121.76 70.73 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 174.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.99 -34.89 17.47 Favored 'Trans proline' 0 N--CA 1.477 0.526 0 C-N-CA 124.202 3.268 . . . . 0.0 114.977 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.75 -22.44 61.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 111.526 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -140.55 70.65 1.36 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.05 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.4 mt -86.33 121.21 37.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.846 0.355 . . . . 0.0 110.772 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -104.51 126.55 51.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.615 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.8 mt -103.66 109.79 28.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 120.655 0.264 . . . . 0.0 110.551 176.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -107.15 99.13 8.7 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.157 0.98 . . . . 0.0 110.626 175.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -68.14 -4.32 13.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.739 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -80.01 -22.66 42.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.602 0.239 . . . . 0.0 110.823 -178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -101.17 -24.42 14.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.782 0.325 . . . . 0.0 110.153 176.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.48 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 37.4 mt -59.46 125.2 22.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.071 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.32 149.6 91.56 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.051 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -42.7 -36.43 4.94 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.722 2.281 . . . . 0.0 113.452 174.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 m -56.92 -55.02 39.92 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.411 0.148 . . . . 0.0 111.215 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -59.84 -46.11 90.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.208 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.96 -37.32 76.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -73.77 -44.81 54.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.5 -39.83 92.34 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.848 0.356 . . . . 0.0 110.435 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 71' ' ' VAL . 90.8 mt -60.67 -55.79 29.05 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.27 175.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -55.77 -45.9 78.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.341 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.06 -39.09 77.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -77.44 -47.16 20.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.038 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.506 HG11 HD13 ' A' ' 25' ' ' LEU . 16.6 m -62.72 -36.56 75.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.078 0.466 . . . . 0.0 110.735 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.0 p -72.22 -30.71 65.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.701 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -71.79 -19.97 61.93 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.862 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.498 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 47.6 t -90.95 -51.86 5.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.766 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.466 ' HG ' HD22 ' A' ' 25' ' ' LEU . 65.5 mt -79.21 -37.96 36.89 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 72' ' ' THR . 31.5 mtp180 -79.51 -5.53 55.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.75 -177.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.2 tttt . . . . . 0 C--N 1.324 -0.508 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.931 176.705 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 68.6 mt . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.74 103.34 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.138 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.7 ttmm -93.91 100.83 12.92 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -105.47 124.1 48.99 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.561 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 64.3 mttm . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.705 -177.122 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 120.944 0.402 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -73.49 141.67 80.23 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.45 123.66 14.29 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 123.115 2.543 . . . . 0.0 112.016 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.4 mmt -57.63 132.41 53.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.145 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 p -77.75 174.77 10.61 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.47 -45.96 84.21 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 109.919 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -56.41 -44.86 80.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.816 -179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.69 -47.09 79.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.432 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -57.79 -40.4 79.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.277 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ttp-105 -59.97 -45.43 92.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.238 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -61.78 -41.43 97.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.383 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.718 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.11 -41.16 82.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.925 -178.234 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.424 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 98.5 p -63.15 -25.16 68.22 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.526 -0.734 . . . . 0.0 110.592 175.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.9 mt -82.24 -45.28 15.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.633 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.718 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -61.78 -42.25 98.75 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.82 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.479 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.4 mt -59.65 -40.69 82.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.067 0.461 . . . . 0.0 110.656 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -71.33 -20.11 62.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.307 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.7 mtpp -85.15 -14.86 45.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.13 0.491 . . . . 0.0 110.437 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' CD1' HG11 ' A' ' 71' ' ' VAL . 92.7 mt -80.03 139.69 53.34 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.189 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 98.6 Cg_endo -80.61 171.84 14.12 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 123.206 2.604 . . . . 0.0 112.983 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.68 -38.68 64.54 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.622 -0.323 . . . . 0.0 113.33 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -50.53 -56.39 11.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.603 0.716 . . . . 0.0 110.929 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.603 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.3 mptp? -78.24 -27.91 47.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.595 -175.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.08 -31.06 64.85 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.745 175.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.39 -40.91 96.68 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.655 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.415 ' HG2' ' CE1' ' A' ' 70' ' ' TYR . 5.0 tpp180 -73.74 -40.99 63.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.428 0.156 . . . . 0.0 110.8 178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.7 t -56.58 -55.05 21.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.876 0.37 . . . . 0.0 110.65 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.421 HG21 HD11 ' A' ' 52' ' ' ILE . 7.1 p -65.71 -27.85 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -65.27 -43.64 90.62 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.844 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.25 -42.77 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.145 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.1 mt -62.64 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.767 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -63.66 -32.43 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -173.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -72.58 -38.63 67.84 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.812 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.99 -30.8 56.1 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.93 0.395 . . . . 0.0 110.539 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.4 ' CD ' ' HZ2' ' A' ' 60' ' ' LYS . 31.3 mm-40 -117.9 82.07 16.53 Favored Pre-proline 0 N--CA 1.445 -0.685 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.034 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.5 -8.72 23.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.587 2.191 . . . . 0.0 112.838 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -87.48 -5.08 58.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.136 0.493 . . . . 0.0 110.439 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -105.11 25.56 10.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.148 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -76.72 -10.72 59.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.439 0.638 . . . . 0.0 109.684 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -78.99 0.5 27.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.767 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.2 m -69.78 99.37 1.35 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.253 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 p30 -57.06 124.35 65.09 Favored Pre-proline 0 CA--C 1.517 -0.295 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 173.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.6 Cg_exo -57.63 -11.69 9.64 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.935 2.424 . . . . 0.0 112.172 177.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -84.05 -36.07 23.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.634 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -136.44 65.31 1.52 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.775 0.322 . . . . 0.0 111.536 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.421 HD11 HG21 ' A' ' 34' ' ' VAL . 18.1 mt -76.49 124.52 34.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.117 0.484 . . . . 0.0 111.438 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -108.82 110.73 22.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.837 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 53.8 mt -82.27 110.42 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.77 0.319 . . . . 0.0 110.383 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.653 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.0 t70 -103.95 99.0 8.76 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -71.97 -8.12 52.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.169 -176.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -84.22 -34.0 23.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.868 0.366 . . . . 0.0 110.792 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 56.6 p -78.15 -31.89 49.99 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.839 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 32.5 mt -58.91 128.48 37.44 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.904 -176.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.4 ' HZ2' ' CD ' ' A' ' 41' ' ' GLU . 13.8 mtmm -72.36 150.97 91.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.871 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.15 -36.75 29.57 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.363 2.042 . . . . 0.0 112.518 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -59.26 -47.27 85.97 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.488 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -63.76 -47.67 80.07 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.173 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 71.6 mt -59.35 -35.26 73.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.086 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.9 tpt180 -72.1 -46.22 57.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.083 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -66.48 -39.71 88.91 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.962 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' HG13 ' A' ' 71' ' ' VAL . 89.7 mt -56.96 -57.06 14.18 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.699 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.06 -42.48 76.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.244 177.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 54.1 ttp85 -64.49 -33.45 75.92 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.162 0.506 . . . . 0.0 110.57 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.415 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 71.5 t80 -80.72 -47.17 14.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.782 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.485 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.0 m -62.54 -37.97 80.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.104 0.478 . . . . 0.0 110.637 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.8 p -70.28 -36.7 74.55 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.849 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -62.66 -28.01 69.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.393 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.603 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 44.4 t -89.55 -54.24 4.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.595 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.485 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.9 mt -76.1 -35.88 59.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -171.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 72' ' ' THR . 54.4 mtp180 -75.73 -5.43 45.66 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.043 -177.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 49.9 tttp . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.741 175.914 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 60.4 mt . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 121.113 0.482 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.424 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 66.6 t -77.73 134.45 28.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.467 -174.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -111.23 131.76 54.87 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.58 144.63 30.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.129 0.49 . . . . 0.0 110.538 173.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 56.8 mttm . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.398 179.029 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.547 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 74.8 m . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -71.32 144.95 90.08 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.986 0.422 . . . . 0.0 110.637 176.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -61.41 124.83 15.47 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.809 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.501 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -56.64 134.82 54.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.176 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 m -95.68 176.51 6.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -51.55 -54.5 26.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -166.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -48.93 -49.8 38.44 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.264 0.554 . . . . 0.0 110.691 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.94 -46.1 90.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.455 -174.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.501 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.8 mttt -58.01 -42.14 84.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.444 177.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -62.26 -44.76 95.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.334 177.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -63.93 -38.07 89.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.373 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.648 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.62 -39.19 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.756 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.6 p -64.26 -26.24 68.41 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.515 -0.74 . . . . 0.0 110.357 175.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 70.8 mt -81.68 -44.72 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.583 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.648 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.2 p30 -62.85 -41.7 99.47 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.676 178.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.525 ' HA ' HD12 ' A' ' 25' ' ' LEU . 94.2 mt -60.26 -41.0 85.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.003 0.43 . . . . 0.0 110.679 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -71.16 -24.18 62.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.245 -177.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 29.1 mtpp -80.31 -22.0 41.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 22' ' ' ILE . 92.1 mt -70.27 139.0 86.94 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.489 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 74.4 Cg_endo -75.15 161.89 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.975 2.45 . . . . 0.0 111.463 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.93 -22.86 58.37 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.337 -0.847 . . . . 0.0 114.003 -170.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -64.42 -52.08 59.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.338 0.589 . . . . 0.0 110.218 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 2.6 mptp? -69.31 -23.76 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.842 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.61 -27.52 69.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.65 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.86 -33.76 84.58 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.881 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.436 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.9 tpp180 -81.07 -40.84 23.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.447 0.165 . . . . 0.0 110.812 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.478 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.4 t -58.03 -52.05 63.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.918 0.39 . . . . 0.0 110.774 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.96 -30.16 49.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -177.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.53 -41.99 92.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.756 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 32' ' ' ARG . 71.2 mt -64.79 -41.75 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.103 178.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 33' ' ' VAL . 60.9 mt -64.19 -61.5 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.353 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.528 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 28.5 mt-30 -63.17 -30.32 71.49 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -76.48 -36.79 57.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -80.3 -28.2 38.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.662 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.482 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 58.5 mm-40 -111.43 81.35 3.04 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.075 176.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.07 -15.07 47.2 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.395 2.063 . . . . 0.0 112.718 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -84.9 -3.79 58.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.146 0.498 . . . . 0.0 110.494 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.59 23.72 14.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.79 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -64.4 -26.23 68.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.206 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -95.61 41.51 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.342 -178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.528 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 68.7 m -80.24 107.16 12.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 2.9 p30 -55.84 122.78 48.73 Favored Pre-proline 0 C--O 1.228 -0.066 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.63 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -61.18 -9.03 11.39 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.127 2.551 . . . . 0.0 112.648 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.484 ' CG ' ' HG2' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -82.98 -44.36 15.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.928 179.36 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' CG ' ' A' ' 50' ' ' ASP . 5.5 mm-40 -133.57 70.53 1.46 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.481 -177.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.4 mt -74.35 116.14 16.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 CA-C-O 121.319 0.58 . . . . 0.0 110.253 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.541 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.0 mm-40 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.59 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.439 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 47.7 mt -89.63 107.8 18.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 175.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -107.95 98.74 8.27 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.224 1.011 . . . . 0.0 110.76 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -66.78 -7.95 24.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.849 -176.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.94 -20.31 49.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -177.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.6 p -104.5 -29.58 10.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.445 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.461 HD22 HG23 ' A' ' 37' ' ' ILE . 36.2 mt -51.28 123.93 10.65 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.365 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.482 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 57.4 mttp -67.01 152.56 95.88 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.271 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.65 -40.81 30.93 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.444 2.096 . . . . 0.0 112.998 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 21.9 t -54.64 -50.96 66.87 Favored 'General case' 0 C--N 1.334 -0.107 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -51.05 71.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.43 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.47 -39.74 73.71 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.168 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.547 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 22.7 tpt180 -72.51 -46.75 53.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.344 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.2 mt-10 -68.22 -39.37 82.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.754 0.311 . . . . 0.0 110.718 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.435 HD22 HG11 ' A' ' 33' ' ' VAL . 86.9 mt -56.88 -55.25 36.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.593 173.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -56.04 -40.27 73.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.138 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -62.24 -43.71 98.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.441 0.639 . . . . 0.0 110.041 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -74.52 -43.89 53.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.716 -174.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.51 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.0 m -65.16 -37.63 80.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.993 0.425 . . . . 0.0 110.71 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 36.7 p -74.43 -35.71 63.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.327 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.7 p -67.27 -19.93 65.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.428 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.499 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 18.1 t -91.28 -54.84 3.75 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.626 178.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.45 ' HG ' HD22 ' A' ' 25' ' ' LEU . 72.3 mt -78.26 -33.86 49.38 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -171.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 72' ' ' THR . 67.5 mtp180 -81.32 0.09 38.68 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.713 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.704 173.816 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 40.6 mt . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.002 0.429 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 40.8 t -96.89 109.69 23.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.483 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.541 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 20.9 ttmm -95.8 111.05 23.11 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -127.67 144.35 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.613 176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.412 -178.386 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.8 m . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.851 0.358 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -72.08 147.01 90.64 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -62.77 123.7 12.78 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.874 2.383 . . . . 0.0 112.012 -176.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.523 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -55.37 136.02 49.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.625 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.7 m -91.75 175.21 6.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -51.76 -57.84 8.12 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -164.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -56.44 -34.12 66.53 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -177.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.36 -45.96 71.41 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.3 mttt -60.07 -42.12 93.87 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.846 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 16' ' ' ARG . 18.4 ttp85 -62.68 -43.5 98.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.483 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -67.23 -42.08 84.63 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.821 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.34 -50.03 74.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.264 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.402 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.1 p -59.77 -33.77 72.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.211 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.2 mt -71.59 -42.22 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.757 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.428 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 67.7 m-20 -62.61 -44.31 96.61 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.548 0.214 . . . . 0.0 111.165 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.472 ' HA ' HD12 ' A' ' 25' ' ' LEU . 96.8 mt -61.22 -34.31 60.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 0.0 111.35 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.98 -24.51 32.89 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.043 0.925 . . . . 0.0 108.747 -174.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HD3' HD22 ' A' ' 75' ' ' LEU . 19.8 ttmt -73.06 -32.33 64.97 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.786 173.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 22' ' ' ILE . 90.0 mt -62.6 142.12 96.77 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 121.153 0.502 . . . . 0.0 111.843 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.459 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.5 Cg_endo -82.38 169.56 13.94 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 123.045 2.497 . . . . 0.0 112.874 176.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.6 -46.0 53.83 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 114.482 0.553 . . . . 0.0 114.482 -172.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -47.27 -56.83 6.02 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.823 0.82 . . . . 0.0 110.989 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.609 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -74.4 -24.88 59.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.814 -174.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -65.13 -27.41 68.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.266 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.24 -34.38 89.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.967 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 36' ' ' ILE . 19.4 tpp180 -77.7 -39.65 44.0 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.504 ' O ' HG13 ' A' ' 37' ' ' ILE . 87.0 t -57.64 -55.24 22.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.024 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 p -63.51 -30.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.898 0.38 . . . . 0.0 110.615 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -63.86 -42.12 97.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.749 176.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.3 mt -66.0 -44.83 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -61.67 -60.55 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.165 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.36 -35.92 74.78 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -79.24 -33.85 43.26 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.98 -26.81 36.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.503 176.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG3' HD23 ' A' ' 59' ' ' LEU . 61.3 mm-40 -115.72 85.33 13.96 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.762 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -63.51 -13.2 34.91 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.23 1.954 . . . . 0.0 112.424 178.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.7 m -79.85 -10.04 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.001 0.429 . . . . 0.0 110.565 176.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -108.81 29.01 7.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.119 0.485 . . . . 0.0 110.21 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -69.12 -23.75 64.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.335 -175.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -95.55 25.02 4.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.503 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 p -73.25 101.03 3.27 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.398 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -56.06 122.48 48.07 Favored Pre-proline 0 C--O 1.227 -0.131 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.452 178.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -58.25 -14.37 19.56 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.936 2.424 . . . . 0.0 112.039 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.07 -37.44 29.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.699 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -136.92 59.97 1.67 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.645 0.259 . . . . 0.0 111.442 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 19.7 mt -70.16 124.02 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.026 0.441 . . . . 0.0 111.496 -175.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.41 ' CD ' ' HB2' ' B' ' 206' ' ' LYS . 44.8 mm-40 -109.84 115.25 29.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.629 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 34.5 mt -90.11 109.97 21.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 177.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 16.0 p-10 -105.98 99.01 8.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.83 0.824 . . . . 0.0 110.659 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -69.94 -0.26 7.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.699 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -87.88 -22.58 24.33 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.219 -175.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 75.4 p -102.18 -32.9 9.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.834 176.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.5 mt -48.3 123.03 5.9 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.025 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -65.26 152.04 92.68 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.792 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -48.76 -35.04 29.43 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.435 2.09 . . . . 0.0 112.321 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 t -56.37 -53.04 62.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 176.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -46.54 88.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.718 -178.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.14 -36.18 74.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -76.83 -45.31 29.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.076 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -62.29 -45.51 92.92 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.527 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.569 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.4 mt -57.37 -55.41 35.18 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.109 176.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -55.45 -47.99 75.19 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.17 -40.57 81.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.883 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -74.29 -47.57 33.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.641 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.569 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.8 m -65.26 -35.34 75.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.81 0.338 . . . . 0.0 110.312 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.461 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 35.6 p -72.88 -39.69 66.21 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.647 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 91.8 p -63.9 -21.77 66.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.729 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.609 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.2 t -90.77 -48.22 7.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.798 0.332 . . . . 0.0 110.316 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.43 ' HG ' HD22 ' A' ' 25' ' ' LEU . 70.6 mt -82.37 -37.09 26.14 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -171.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.461 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 82.6 mtp180 -77.08 -7.41 55.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.076 0.465 . . . . 0.0 110.377 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.507 173.93 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.185 0.517 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.402 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.3 t -114.92 104.09 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.359 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.612 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.1 ttmm -90.12 109.59 20.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 171.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -124.65 137.84 54.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp . . . . . 0 C--N 1.319 -0.747 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.353 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.941 0.401 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -65.8 147.18 98.88 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.341 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -72.07 140.55 34.71 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.594 2.196 . . . . 0.0 111.252 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.49 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.63 120.2 23.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.297 -177.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.9 p -69.92 179.45 2.26 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.51 -50.81 72.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 121.273 -0.171 . . . . 0.0 110.981 -173.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -56.8 -41.76 78.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.834 0.35 . . . . 0.0 111.073 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.29 -44.96 93.53 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.731 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.9 mttt -62.7 -41.04 98.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.688 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttp85 -64.36 -43.15 95.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 110.107 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.24 -41.73 97.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.739 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.764 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.99 -32.6 72.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.103 -176.04 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.6 p -68.38 -26.76 65.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.624 -0.673 . . . . 0.0 109.925 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.7 mt -83.8 -39.18 20.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.691 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.764 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.5 p30 -66.17 -41.1 90.78 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.896 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.8 mt -60.94 -40.31 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 0.0 110.096 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -66.67 -29.07 68.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 48.6 mttp -66.25 -28.65 68.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.107 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.515 ' CD1' HG11 ' A' ' 71' ' ' VAL . 94.5 mt -76.39 135.84 68.83 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.385 -171.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.437 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 86.7 Cg_endo -81.72 171.94 12.73 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.265 2.643 . . . . 0.0 112.531 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.83 -45.11 61.32 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 114.333 0.493 . . . . 0.0 114.333 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -46.66 -52.69 13.22 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.532 0.682 . . . . 0.0 111.478 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.505 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -80.47 -29.24 37.44 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.057 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' B' ' 207' ' ' PHE . 12.9 tp -63.19 -24.28 67.81 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.825 0.345 . . . . 0.0 110.2 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.76 -37.02 94.14 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 111.807 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.479 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.7 tpp180 -75.47 -39.02 59.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.0 t -57.33 -55.01 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.076 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.49 -30.81 51.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.022 0.439 . . . . 0.0 110.482 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -64.29 -41.54 96.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.153 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 32' ' ' ARG . 67.7 mt -63.76 -47.35 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.396 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 33' ' ' VAL . 46.5 mt -63.95 -59.56 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.341 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.58 -31.29 70.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 t -77.99 -39.53 42.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.891 -0.324 . . . . 0.0 111.401 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.06 -28.58 57.68 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.073 0.463 . . . . 0.0 110.447 176.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -116.9 78.98 9.76 Favored Pre-proline 0 N--CA 1.44 -0.929 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.468 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.27 -15.66 49.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.18 1.92 . . . . 0.0 112.391 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.3 t -73.08 -12.72 61.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.133 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.09 23.31 14.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -65.29 -31.6 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.725 0.297 . . . . 0.0 111.262 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -85.65 41.95 0.93 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.255 0.55 . . . . 0.0 110.735 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.0 m -84.5 99.99 11.07 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -52.81 117.01 10.05 Favored Pre-proline 0 CA--C 1.523 -0.093 0 O-C-N 123.75 0.656 . . . . 0.0 110.233 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.97 -31.74 45.0 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.701 2.934 . . . . 0.0 114.222 -172.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -73.87 -27.74 61.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.2 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -141.49 79.18 1.67 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.152 0.501 . . . . 0.0 109.652 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.5 mt -89.84 126.55 42.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.891 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.5 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 33.9 mm-40 -98.78 123.34 42.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.917 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.435 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.4 mt -98.01 108.59 22.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 170.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -108.92 100.8 9.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.141 0.972 . . . . 0.0 110.587 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -70.58 -2.85 15.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.546 -1.206 . . . . 0.0 112.128 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -83.0 -23.29 33.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.0 p -97.98 -26.67 14.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.958 0.409 . . . . 0.0 110.095 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.2 mt -58.75 127.53 32.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.047 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -69.76 147.8 96.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -44.19 -34.82 7.29 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.54 2.16 . . . . 0.0 113.095 173.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.6 m -56.69 -51.71 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.145 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -63.37 -45.65 90.14 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.261 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.7 mt -59.07 -35.09 72.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.717 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -71.54 -51.54 22.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.121 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -57.49 -42.86 83.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.543 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.489 ' O ' HG13 ' A' ' 71' ' ' VAL . 78.8 mt -58.69 -58.96 6.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.6 177.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.428 ' O ' HG22 ' A' ' 71' ' ' VAL . 29.0 tt0 -57.21 -45.42 83.84 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.765 0.317 . . . . 0.0 111.297 -178.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -58.54 -38.63 78.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.27 0.557 . . . . 0.0 110.612 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -75.59 -47.89 24.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.653 -177.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 25' ' ' LEU . 11.5 m -62.9 -39.85 86.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.069 0.461 . . . . 0.0 110.396 -176.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.537 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.6 p -68.67 -30.81 69.58 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.105 -178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 85.6 p -68.96 -23.19 64.11 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.377 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.505 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 45.6 t -92.43 -44.95 8.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.121 0.486 . . . . 0.0 110.542 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 21' ' ' ASP . 27.9 mt -83.41 -33.76 25.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.574 -171.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.3 mtp180 -78.31 -1.56 33.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.249 0.547 . . . . 0.0 110.05 176.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 tttp . . . . . 0 N--CA 1.451 -0.411 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.253 172.885 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . 0.435 ' N ' HD13 ' B' ' 204' ' ' ILE . 4.3 mp . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.846 0.355 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.435 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 60.4 t -104.05 109.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.136 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.5 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.1 ttmm -99.75 81.9 2.53 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.55 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.5 p90 -93.35 159.19 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.003 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.592 ' SG ' ' HB2' ' A' ' 65' ' ' ARG . 52.8 t . . . . . 0 CA--C 1.516 -0.327 0 CA-C-O 120.746 0.307 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -85.23 145.31 42.54 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.027 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -64.23 127.45 19.24 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.85 2.367 . . . . 0.0 111.69 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -61.27 128.86 38.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.226 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.6 p -75.0 176.73 6.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -48.23 80.76 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -53.31 -46.84 69.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.364 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.27 -45.23 77.26 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.864 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.425 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.9 mttt -56.46 -38.56 71.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.18 175.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -60.93 -45.31 95.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.314 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -62.95 -39.94 96.15 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.591 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.613 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -69.07 -30.64 69.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.202 -178.269 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.512 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 80.9 p -69.71 -30.03 67.56 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.431 -0.793 . . . . 0.0 110.011 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.6 mt -80.25 -39.18 29.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.608 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.613 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.3 p30 -68.0 -42.48 80.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.397 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -59.5 -39.36 79.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.558 177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -67.16 -30.86 70.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.902 0.382 . . . . 0.0 111.138 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -62.54 -30.04 71.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.842 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.532 ' CD1' HG11 ' A' ' 71' ' ' VAL . 95.9 mt -73.36 139.28 78.44 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.381 -172.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.03 170.28 15.34 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.127 2.552 . . . . 0.0 112.866 177.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.79 -46.26 48.49 Favored Glycine 0 C--N 1.333 0.39 0 O-C-N 123.368 0.418 . . . . 0.0 113.649 -174.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.6 mp0 -47.03 -56.87 5.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.265 0.555 . . . . 0.0 110.988 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -27.09 61.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.52 -176.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.2 -25.16 67.64 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.773 0.32 . . . . 0.0 110.547 178.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.38 92.74 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.073 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 32' ' ' ARG . 5.4 tpp180 -76.8 -40.19 48.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.666 0.27 . . . . 0.0 110.537 177.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.433 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.0 t -57.75 -54.07 36.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.897 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.31 -29.84 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.573 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.87 -45.29 90.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.644 176.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.9 mt -63.7 -47.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.845 -179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.6 mt -62.63 -58.99 5.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.768 -178.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -62.74 -30.98 71.84 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.3 t -70.39 -50.73 35.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.602 0.239 . . . . 0.0 110.895 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -69.29 -30.85 69.02 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.94 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.406 ' CD ' ' HZ1' ' A' ' 60' ' ' LYS . 15.9 mm-40 -116.97 81.29 12.14 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.649 -178.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.03 -18.38 64.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.4 2.066 . . . . 0.0 113.104 -177.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.7 t -70.42 -27.79 64.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.036 0.446 . . . . 0.0 110.114 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.38 23.27 1.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.833 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -72.03 -13.0 61.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.365 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -85.14 4.8 32.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.286 0.565 . . . . 0.0 110.621 -177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.4 m -66.86 104.7 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.159 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 123.66 71.89 Favored Pre-proline 0 CA--C 1.52 -0.2 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 173.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.75 -14.28 17.12 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.001 2.468 . . . . 0.0 112.409 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.04 -33.64 22.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.928 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -137.29 68.02 1.42 Allowed 'General case' 0 C--O 1.227 -0.112 0 CA-C-O 120.713 0.292 . . . . 0.0 110.758 -178.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.9 mt -78.42 122.09 32.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.346 -175.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -102.34 122.13 43.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.558 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.0 mt -93.63 109.0 21.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -105.42 95.51 5.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.14 0.972 . . . . 0.0 110.627 176.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -66.47 -5.27 10.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.28 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -82.23 -27.97 32.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.634 0.254 . . . . 0.0 110.944 -177.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.3 p -93.05 -22.48 19.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 27.1 mt -59.9 131.8 51.99 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.078 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.406 ' HZ1' ' CD ' ' A' ' 41' ' ' GLU . 11.8 mtmm -82.79 153.84 67.66 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.119 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.2 -43.94 24.83 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.446 2.097 . . . . 0.0 113.057 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 70.6 m -52.23 -52.0 54.96 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.147 0.279 . . . . 0.0 111.153 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -60.75 -45.68 93.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 64.0 mt -60.9 -36.83 80.27 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.01 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.592 ' HB2' ' SG ' ' A' ' 7' ' ' CYS . 32.1 tpt180 -70.75 -50.33 37.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 177.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 62' ' ' SER . 60.0 mm-40 -59.05 -41.05 86.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.905 0.383 . . . . 0.0 110.225 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.4 HD22 HG11 ' A' ' 33' ' ' VAL . 80.1 mt -61.91 -58.16 9.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.692 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.429 ' O ' HG22 ' A' ' 71' ' ' VAL . 23.4 tt0 -54.48 -45.23 73.16 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.056 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.86 -36.23 80.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.924 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -75.78 -49.11 19.06 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.549 -178.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.532 HG11 ' CD1' ' A' ' 25' ' ' LEU . 13.7 m -62.65 -40.36 88.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.122 0.486 . . . . 0.0 110.537 -175.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.1 p -65.63 -35.14 79.92 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.082 -177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.9 p -66.0 -24.77 66.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 110.624 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 44.0 t -91.33 -41.99 10.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.743 0.306 . . . . 0.0 110.579 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 21' ' ' ASP . 29.8 mt -89.7 -38.36 13.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -168.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -73.28 -4.71 34.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.853 0.835 . . . . 0.0 109.227 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.0 tttt . . . . . 0 N--CA 1.448 -0.555 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.132 170.952 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 CA--C 1.522 -0.129 0 CA-C-O 121.794 0.807 . . . . 0.0 111.401 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.512 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 57.7 t -87.8 113.47 25.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.103 -176.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 19.7 ttmm -96.51 113.77 25.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.73 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -125.38 139.73 53.41 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.351 0.596 . . . . 0.0 110.6 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 62.7 mttm . . . . . 0 C--N 1.32 -0.699 0 CA-C-N 115.316 -0.856 . . . . 0.0 108.696 175.017 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.478 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 55.7 m . . . . . 0 N--CA 1.444 -0.729 0 CA-C-O 121.225 0.536 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -87.4 143.91 34.98 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.785 177.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.08 123.31 12.64 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.795 2.33 . . . . 0.0 111.433 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.431 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.4 mmt -62.81 130.12 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.634 -176.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.0 m -90.14 177.68 6.37 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -57.64 -54.11 50.58 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -165.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -48.99 -41.26 33.76 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.41 -48.39 70.2 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.694 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 10' ' ' MET . 95.0 mttt -57.58 -40.73 79.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.279 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -63.78 -47.07 82.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.335 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -60.33 -46.11 91.05 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.19 -48.21 82.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.471 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.572 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.7 p -60.81 -32.99 72.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.144 0.497 . . . . 0.0 110.753 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -76.68 -34.93 58.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.547 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.501 ' O ' HD13 ' A' ' 75' ' ' LEU . 64.0 m-20 -68.91 -41.93 77.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.228 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.16 -35.22 60.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.948 0.404 . . . . 0.0 110.664 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.95 -24.88 59.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.764 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.44 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.6 mttp -66.33 -42.84 87.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.295 0.569 . . . . 0.0 110.363 172.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.484 HD13 HG11 ' A' ' 71' ' ' VAL . 96.1 mt -58.41 136.04 85.45 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.651 -174.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.529 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.1 Cg_endo -80.3 172.43 13.7 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.381 2.72 . . . . 0.0 112.88 177.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.46 -46.3 52.86 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 123.328 0.393 . . . . 0.0 114.034 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -48.71 -58.21 5.11 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.208 0.528 . . . . 0.0 111.843 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.529 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.3 mptp? -71.22 -23.91 62.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.964 -175.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -63.63 -26.72 68.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.336 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.63 89.87 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.026 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.404 ' O ' HG13 ' A' ' 36' ' ' ILE . 22.6 tpp180 -78.76 -41.0 31.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.538 0.209 . . . . 0.0 110.578 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.448 ' O ' HG13 ' A' ' 37' ' ' ILE . 95.6 t -55.97 -55.53 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.004 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.97 -31.8 53.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.604 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -64.95 -41.09 95.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.884 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.7 mt -64.95 -44.93 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.177 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -62.25 -61.64 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.972 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -61.78 -31.83 72.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -173.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -79.81 -30.93 40.65 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.698 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -83.96 -25.32 30.16 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.227 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.06 81.68 16.6 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.508 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.89 -16.18 53.33 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.694 2.263 . . . . 0.0 113.116 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 m -78.48 -8.4 58.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.013 0.435 . . . . 0.0 110.317 176.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.6 mt -110.07 28.81 8.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.228 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -81.81 -8.33 59.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.469 0.652 . . . . 0.0 110.514 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -103.4 30.46 4.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.708 176.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.0 m -72.48 110.88 7.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.578 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.79 118.6 13.73 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 123.204 0.315 . . . . 0.0 110.202 175.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.99 -13.03 32.61 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.705 2.27 . . . . 0.0 111.109 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.653 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 4.3 m-20 -78.29 -37.46 44.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.16 -178.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.11 60.94 1.36 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.502 0.191 . . . . 0.0 110.993 -176.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 16.2 mt -63.21 123.48 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.039 0.447 . . . . 0.0 111.898 -173.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' B' ' 206' ' ' LYS . 41.0 mm-40 -100.7 116.96 33.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.432 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.419 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.6 mt -95.35 107.25 19.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 174.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -107.48 98.38 8.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.907 0.861 . . . . 0.0 110.273 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -68.59 -6.07 23.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.867 -1.061 . . . . 0.0 112.162 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -76.8 -31.11 56.75 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.77 0.319 . . . . 0.0 110.84 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 p -93.32 -22.82 18.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.43 131.56 50.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.11 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -74.29 152.8 88.11 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.079 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -49.27 -34.88 32.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.599 2.199 . . . . 0.0 111.939 174.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.5 m -56.79 -52.4 65.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.252 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.18 -47.86 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.616 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.02 -35.3 69.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.15 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.478 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 27.9 tpt180 -73.35 -49.97 24.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.779 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -63.63 -41.51 98.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.782 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.543 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.3 mt -58.33 -55.87 29.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.334 176.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -55.81 -47.75 76.62 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.882 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -57.65 -38.15 74.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.097 0.475 . . . . 0.0 110.873 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -75.61 -49.28 18.96 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.589 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.543 HG13 ' O ' ' A' ' 67' ' ' LEU . 6.3 m -63.91 -39.85 86.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.763 0.316 . . . . 0.0 110.27 -175.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.6 p -67.04 -35.64 80.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.11 -178.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -67.91 -24.51 65.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.866 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.1 t -91.96 -26.26 18.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.05 0.452 . . . . 0.0 110.814 -178.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 21' ' ' ASP . 31.1 mt -103.45 -44.99 4.98 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -171.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -69.88 -16.09 63.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.0 tttt . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.043 176.805 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 32.4 mm . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.572 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.4 t -109.64 129.74 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.253 -173.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 53' ' ' GLU . 37.6 ttmt -118.25 117.66 29.72 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.42 145.08 49.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.252 0.549 . . . . 0.0 111.274 -178.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 55.9 mttp . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.294 173.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 85.3 m . . . . . 0 C--O 1.234 0.271 0 CA-C-O 120.798 0.332 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.03 148.34 47.66 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.093 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.18 129.8 28.35 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.0 2.467 . . . . 0.0 112.399 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.444 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -66.31 132.7 48.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.48 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 p -75.44 177.04 6.96 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.3 -47.81 84.45 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.285 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.68 -47.05 70.8 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.345 0.593 . . . . 0.0 109.874 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.26 -46.86 84.88 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.652 -176.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.444 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.2 mttt -58.19 -40.01 80.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.154 176.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -63.25 -42.94 99.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.547 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -64.37 -36.06 82.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.943 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.729 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.42 -31.8 69.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.735 178.818 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.51 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 60.4 p -70.0 -25.32 63.55 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.569 -0.707 . . . . 0.0 110.001 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.3 -39.27 17.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.334 -178.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.729 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -67.61 -41.27 84.27 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.804 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.451 ' HA ' HD12 ' A' ' 25' ' ' LEU . 41.7 mt -60.17 -38.6 77.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.171 0.51 . . . . 0.0 110.15 174.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -68.35 -31.15 70.34 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.753 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -63.39 -38.87 92.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.024 173.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.499 ' CD1' HG11 ' A' ' 71' ' ' VAL . 94.3 mt -64.38 135.17 96.24 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.681 -173.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.512 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -80.36 172.78 13.21 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.533 2.822 . . . . 0.0 113.012 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.8 -46.93 48.18 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.275 0.47 . . . . 0.0 114.275 -172.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.1 mp0 -48.74 -52.6 22.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.683 0.754 . . . . 0.0 111.335 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.5 mptp? -76.4 -24.36 54.07 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.193 -173.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.87 -29.19 68.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.046 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.04 -43.72 99.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.783 176.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.558 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.6 tpm_? -68.47 -42.11 79.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.686 0.279 . . . . 0.0 110.66 177.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.453 HG11 HD22 ' A' ' 67' ' ' LEU . 88.3 t -58.17 -58.03 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.927 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 p -62.45 -29.53 47.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.514 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -69.63 -41.82 75.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.323 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.558 HG13 ' HE ' ' A' ' 32' ' ' ARG . 64.4 mt -61.69 -41.83 91.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 175.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.441 HG23 HD22 ' A' ' 59' ' ' LEU . 72.7 mt -62.7 -60.45 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.002 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -174.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -72.53 -42.89 64.24 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.988 -178.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.27 -35.81 71.5 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.557 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.461 ' CD ' ' HZ2' ' A' ' 60' ' ' LYS . 55.6 mm-40 -114.73 86.14 12.53 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.776 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -64.25 -16.26 54.07 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.233 1.956 . . . . 0.0 112.365 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 m -77.36 -12.27 59.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.923 0.392 . . . . 0.0 110.711 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 61.4 mt -99.99 26.44 6.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.123 0.487 . . . . 0.0 110.498 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -70.52 -15.11 62.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.437 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -81.06 11.82 3.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 m -72.57 94.37 1.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.401 176.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.3 119.36 55.56 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -49.84 -31.33 26.08 Favored 'Trans proline' 0 N--CA 1.476 0.452 0 C-N-CA 123.872 3.048 . . . . 0.0 114.651 -174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -74.61 -28.99 61.13 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.134 -0.227 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -140.3 72.95 1.41 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -175.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.532 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 26.8 mt -87.3 126.1 41.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.798 0.332 . . . . 0.0 111.377 -176.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.43 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.8 mm-40 -103.43 116.22 32.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.897 178.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.423 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.0 mt -88.99 108.36 18.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -107.88 100.2 9.59 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 122.135 0.969 . . . . 0.0 110.466 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -67.22 -10.12 47.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.235 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -77.15 -30.21 54.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.098 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.4 p -89.31 -26.58 21.04 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 109.922 177.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.441 HD22 HG23 ' A' ' 37' ' ' ILE . 39.7 mt -59.0 126.97 29.91 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.822 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.461 ' HZ2' ' CD ' ' A' ' 41' ' ' GLU . 20.4 mtmm -68.6 151.11 97.43 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.94 -34.76 17.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.522 2.148 . . . . 0.0 112.436 174.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -55.92 -56.21 23.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.495 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -58.87 -46.29 88.14 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.677 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.5 mt -58.57 -35.76 72.89 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.974 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.465 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 31.0 tpt180 -76.39 -47.39 23.42 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.001 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -60.33 -42.65 96.11 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.771 0.32 . . . . 0.0 110.42 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.453 HD22 HG11 ' A' ' 33' ' ' VAL . 80.2 mt -59.49 -58.27 9.36 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.482 175.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' HG22 ' A' ' 71' ' ' VAL . 28.4 tt0 -54.38 -47.15 73.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -58.03 -37.45 74.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.206 0.527 . . . . 0.0 110.56 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 62.8 t80 -74.77 -47.53 30.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.764 -179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 68' ' ' GLU . 10.7 m -63.42 -40.96 90.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.002 0.43 . . . . 0.0 110.347 -176.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.3 p -67.59 -31.0 70.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.331 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 70' ' ' TYR . 45.2 t -59.96 -33.66 72.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.397 175.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.499 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.5 t -91.56 -36.13 13.87 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.736 0.303 . . . . 0.0 111.025 -175.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 21' ' ' ASP . 21.0 mt -94.17 -29.43 15.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -170.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 72' ' ' THR . 72.2 mtp180 -76.23 -16.42 59.82 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.8 tttp . . . . . 0 N--CA 1.45 -0.427 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.133 171.897 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 50.4 mt . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.51 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 48.7 t -87.69 104.87 14.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.313 -175.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.532 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 3.9 ttmp? -91.73 103.98 16.49 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.473 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -116.65 151.57 36.02 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.383 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp . . . . . 0 C--N 1.319 -0.747 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.174 -178.24 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -83.95 134.08 44.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 121.728 0.775 . . . . 0.0 112.429 -173.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -53.91 129.55 34.76 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 124.069 3.179 . . . . 0.0 112.197 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.5 mmt -66.24 149.19 50.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.725 -175.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.46 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 19.1 p -86.06 172.74 10.38 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 171.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.28 -46.29 90.35 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 118.704 0.684 . . . . 0.0 109.314 -178.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -53.67 -48.13 69.76 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.177 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.43 -44.89 92.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.95 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 11' ' ' SER . 45.3 mttp -59.58 -38.81 82.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.651 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.3 ttp-105 -60.07 -42.14 93.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.074 0.464 . . . . 0.0 109.947 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -63.79 -39.21 93.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.468 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.805 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.62 -39.59 73.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.549 -178.533 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.442 ' HB2' HG21 ' B' ' 205' ' ' VAL . 85.7 p -61.45 -29.74 70.14 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.531 -0.731 . . . . 0.0 110.233 174.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 58.6 mt -78.58 -43.22 27.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.637 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.805 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.8 p30 -63.12 -41.32 99.3 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.682 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.459 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.9 mt -59.31 -41.05 82.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.68 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.411 HD21 ' HA ' ' A' ' 23' ' ' ASN . 8.1 m120 -72.09 -21.0 61.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.649 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.5 mtpp -84.94 -13.4 50.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.06 0.457 . . . . 0.0 110.248 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 96.1 mt -81.73 136.73 47.88 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.978 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.46 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.0 Cg_endo -79.25 171.92 15.45 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.278 2.652 . . . . 0.0 112.941 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.86 -44.59 61.33 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 121.456 -0.402 . . . . 0.0 113.694 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -48.52 -52.75 21.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 122.857 0.463 . . . . 0.0 110.809 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.582 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -76.46 -28.18 56.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.234 -177.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.417 ' O ' HG11 ' A' ' 34' ' ' VAL . 10.8 mt -60.06 -30.25 69.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.877 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.25 -39.81 96.52 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.822 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.413 ' O ' HG13 ' A' ' 36' ' ' ILE . 24.0 tpp180 -72.61 -42.92 63.97 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 177.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.535 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.9 t -57.11 -54.78 25.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.836 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.417 HG11 ' O ' ' A' ' 30' ' ' LEU . 12.0 p -65.72 -29.03 45.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.803 -178.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.84 -42.96 94.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.6 mt -64.6 -43.18 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.263 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 33' ' ' VAL . 49.3 mt -63.22 -62.58 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.83 -36.72 79.82 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -68.86 -46.57 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.423 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.38 -35.23 77.39 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.823 0.344 . . . . 0.0 110.663 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.527 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 29.3 mm-40 -114.17 85.04 9.8 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.909 -174.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.35 -13.64 40.87 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.225 1.95 . . . . 0.0 111.789 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -79.2 -5.47 54.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 177.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 51.9 mt -108.91 33.18 4.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.237 0.542 . . . . 0.0 109.739 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -68.19 -17.84 64.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.425 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.44 41.85 1.01 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.203 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.8 m -98.67 88.1 3.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.119 0.485 . . . . 0.0 110.644 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -68.87 124.33 90.02 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.802 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.43 -21.68 31.09 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.429 2.752 . . . . 0.0 114.275 -174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -72.62 -35.33 67.8 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -144.88 76.56 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.168 -175.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.593 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.0 mt -76.02 127.11 37.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.021 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -100.94 129.11 46.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.63 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 32.9 mt -110.23 108.43 25.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.05 102.65 11.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.046 0.927 . . . . 0.0 110.298 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.9 -13.65 61.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.547 -1.206 . . . . 0.0 112.628 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -77.58 -25.58 50.09 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.238 -177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.5 p -91.49 -23.98 19.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.437 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 22.9 mt -59.5 130.2 45.71 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.63 176.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.527 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 19.8 mttm -73.24 148.49 88.65 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.541 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.41 -34.1 24.62 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.271 1.981 . . . . 0.0 112.248 174.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.3 t -57.12 -55.16 38.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.245 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -60.32 -47.7 84.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.777 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 mt -60.34 -37.08 79.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.117 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.43 -48.02 65.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.572 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -64.16 -44.65 91.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.423 HD22 HG11 ' A' ' 33' ' ' VAL . 94.1 mt -58.43 -56.08 26.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.352 177.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB2' HD13 ' A' ' 18' ' ' LEU . 37.1 tt0 -55.48 -43.79 75.87 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.087 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -61.0 -41.91 97.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 0.0 111.043 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -71.82 -47.36 53.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.714 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.462 HG11 ' CD1' ' A' ' 25' ' ' LEU . 17.5 m -63.75 -38.72 83.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.158 0.504 . . . . 0.0 110.976 -175.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 34.3 p -73.6 -31.61 63.66 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.472 ' O ' ' HD2' ' A' ' 77' ' ' LYS . 31.5 t -69.92 -19.41 63.39 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.256 177.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.582 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 38.4 t -90.46 -55.71 3.48 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.39 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.466 ' HG ' HD22 ' A' ' 25' ' ' LEU . 76.4 mt -77.68 -36.07 51.61 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 72' ' ' THR . 39.8 mtp180 -82.06 -6.37 59.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.807 -176.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.472 ' HD2' ' O ' ' A' ' 73' ' ' SER . 54.6 mttm . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.204 173.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 34.0 mt . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.442 HG21 ' HB2' ' A' ' 19' ' ' SER . 60.6 t -85.23 137.01 21.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.406 -173.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.7 mptp? -119.17 132.75 56.0 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -138.89 145.14 39.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.911 0.386 . . . . 0.0 110.236 174.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 62.8 mttm . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.275 178.251 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.4 m . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.839 0.352 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -68.95 143.05 94.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.099 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.66 132.39 40.08 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.855 2.37 . . . . 0.0 111.27 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.508 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -65.61 126.52 28.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.267 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 p -72.81 175.13 6.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.67 -49.98 75.63 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.655 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -55.59 -41.95 74.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.197 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.57 -45.79 85.51 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.925 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.508 ' HE3' ' O ' ' A' ' 10' ' ' MET . 92.0 mttt -59.94 -42.24 93.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -63.52 -40.29 96.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.376 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -61.33 -41.05 96.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.715 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.87 -33.43 73.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -179.613 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.429 ' HB2' HG22 ' B' ' 205' ' ' VAL . 80.1 p -68.56 -25.97 65.17 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.509 -0.744 . . . . 0.0 110.016 174.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -86.33 -38.15 17.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.416 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.715 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -68.17 -41.15 81.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.667 176.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.59 -37.8 76.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.077 0.465 . . . . 0.0 110.364 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.32 -33.09 73.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.926 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.56 -40.06 95.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.333 0.587 . . . . 0.0 110.469 174.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.515 ' CD1' HG11 ' A' ' 71' ' ' VAL . 91.4 mt -63.97 133.12 95.48 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.117 -175.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.493 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 85.3 Cg_endo -81.25 171.47 13.8 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.185 2.59 . . . . 0.0 112.951 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.6 -43.58 46.05 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 114.443 0.537 . . . . 0.0 114.443 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.522 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 1.3 mp0 -51.76 -57.19 9.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.625 0.726 . . . . 0.0 110.797 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.583 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -71.68 -25.33 62.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.726 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.7 mt -64.29 -24.05 67.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.009 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.94 -33.79 88.14 Favored Glycine 0 C--N 1.335 0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.103 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -79.17 -38.85 34.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.697 0.284 . . . . 0.0 110.356 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.481 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.3 t -59.29 -53.27 50.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.778 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 p -60.51 -33.45 54.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.993 0.425 . . . . 0.0 110.559 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -65.3 -44.44 87.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.173 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -63.47 -46.27 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.469 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.2 mt -60.33 -65.71 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.892 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.447 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 0.0 OUTLIER -58.35 -33.33 69.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -176.589 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 41.1 t -74.27 -27.72 60.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.729 0.299 . . . . 0.0 111.092 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -89.2 -27.37 20.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.063 0.459 . . . . 0.0 110.472 174.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -119.93 87.05 37.67 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.802 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -66.67 -10.64 28.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.167 1.911 . . . . 0.0 111.869 173.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.2 m -85.84 4.44 37.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.8 mt -117.09 47.57 1.47 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 110.588 177.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -90.75 -4.11 56.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.465 0.65 . . . . 0.0 110.037 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -77.66 -13.75 59.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.188 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.447 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.5 m -77.88 86.79 4.1 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.526 176.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -71.24 129.61 88.89 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-N 115.122 -0.944 . . . . 0.0 108.945 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HA ' HD13 ' A' ' 52' ' ' ILE . 59.5 Cg_exo -47.58 -25.51 5.46 Favored 'Trans proline' 0 N--CA 1.479 0.675 0 C-N-CA 124.204 3.27 . . . . 0.0 115.083 -174.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -81.69 -23.26 36.95 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.443 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -144.65 77.89 1.55 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.142 0.496 . . . . 0.0 110.173 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.501 HD12 ' CE1' ' B' ' 207' ' ' PHE . 38.9 mt -91.01 129.4 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.437 -175.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.573 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 28.0 mm-40 -103.63 138.53 40.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.468 174.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.477 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.2 mt -112.81 108.89 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -111.94 99.0 7.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.06 0.933 . . . . 0.0 110.292 174.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -66.19 -12.64 57.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.129 -174.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.82 -26.97 60.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.913 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.3 p -93.38 -26.32 17.31 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.416 HD22 HG23 ' A' ' 37' ' ' ILE . 26.7 mt -59.47 132.4 53.87 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.132 178.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mtmm -81.12 149.75 66.9 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.444 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.82 -41.59 11.82 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.956 2.438 . . . . 0.0 112.867 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -53.05 -54.08 40.7 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.716 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.5 m -61.31 -48.11 82.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.832 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.6 mt -58.01 -35.42 71.23 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.14 0.495 . . . . 0.0 110.976 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.64 -46.09 48.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.783 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -64.78 -42.88 94.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.644 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.38 -56.74 17.96 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.568 177.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.416 ' O ' HG22 ' A' ' 71' ' ' VAL . 20.9 tt0 -55.4 -44.27 76.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.37 -37.77 78.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 110.912 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -78.39 -47.32 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.016 -177.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.4 m -61.46 -41.82 91.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.139 0.495 . . . . 0.0 110.399 -176.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.409 ' H ' HG22 ' A' ' 71' ' ' VAL . 24.9 p -65.66 -35.72 81.59 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.932 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.9 p -68.49 -23.24 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.853 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.583 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.4 t -91.4 -29.54 17.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.87 0.367 . . . . 0.0 110.704 -179.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 21' ' ' ASP . 34.8 mt -101.64 -37.1 8.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -80.89 -3.21 50.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.264 0.554 . . . . 0.0 110.633 -177.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.076 170.863 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 45.8 mm . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.971 0.415 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.477 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 3.5 t -95.69 147.74 5.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.002 -177.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.573 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.8 ttmm -139.09 112.77 8.38 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.501 ' CE1' HD12 ' A' ' 52' ' ' ILE . 30.0 p90 -132.51 136.14 46.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.367 0.603 . . . . 0.0 111.017 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.346 179.766 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.578 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 77.2 m . . . . . 0 C--O 1.235 0.311 0 CA-C-O 121.107 0.479 . . . . 0.0 111.694 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -68.83 144.43 95.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.212 173.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.4 130.6 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.841 2.361 . . . . 0.0 111.746 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.581 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 25.8 mmt -65.88 135.39 54.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.878 -175.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.412 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 22.9 p -84.14 178.33 7.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.883 175.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.02 -50.02 75.68 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 117.672 0.215 . . . . 0.0 110.646 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -53.95 -41.66 68.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.231 0.539 . . . . 0.0 111.102 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.16 -46.86 69.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.581 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.9 mttt -60.46 -36.99 79.57 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.402 177.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -65.05 -41.82 94.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.683 0.278 . . . . 0.0 110.307 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.97 -42.88 99.16 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.97 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.731 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -67.92 -32.13 72.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.289 -177.832 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.1 p -69.53 -26.86 64.72 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 173.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.515 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 82.8 mt -82.93 -46.14 13.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.057 -178.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.731 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -60.46 -41.86 94.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.848 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.484 ' HA ' HD12 ' A' ' 25' ' ' LEU . 34.8 mt -61.34 -42.02 92.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.815 0.341 . . . . 0.0 110.682 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -70.19 -25.87 63.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 0.0 111.212 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 52.1 mtpt -78.92 -19.62 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.993 0.425 . . . . 0.0 110.59 178.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 93.9 mt -75.0 138.64 72.74 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.238 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.48 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 97.4 Cg_endo -79.93 172.03 14.58 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 123.238 2.625 . . . . 0.0 112.954 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.2 -44.44 57.51 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.381 -0.438 . . . . 0.0 113.427 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -47.8 -54.27 12.89 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.325 0.583 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.652 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -79.87 -31.89 40.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.996 -175.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.81 -27.16 68.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.595 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.13 -35.91 79.54 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.867 173.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.461 ' O ' HG13 ' A' ' 36' ' ' ILE . 18.8 tpp180 -79.24 -44.31 22.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.478 0.18 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 37' ' ' ILE . 42.8 t -55.16 -52.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.659 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.28 -31.63 53.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.79 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.0 t60 -69.57 -41.13 76.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.96 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.513 HD13 ' HG3' ' A' ' 66' ' ' GLU . 55.6 mt -64.67 -43.0 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.139 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 33' ' ' VAL . 52.3 mt -62.56 -59.25 4.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.476 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.518 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 31.3 mt-30 -61.69 -31.81 71.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 t -77.02 -47.81 19.64 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.162 -0.336 . . . . 0.0 111.183 -177.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -67.64 -29.99 69.45 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.97 0.414 . . . . 0.0 110.279 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.435 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 33.8 mm-40 -113.32 83.41 6.6 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.096 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -65.52 -15.85 51.38 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.024 1.816 . . . . 0.0 111.287 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.2 m -73.25 -13.87 61.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.55 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 64.0 mt -110.21 27.0 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.097 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -62.1 -32.69 73.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.254 -176.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -88.9 42.88 1.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.153 0.501 . . . . 0.0 110.804 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.518 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.2 m -76.04 92.1 3.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.979 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -52.54 116.99 9.73 Favored Pre-proline 0 CA--C 1.519 -0.223 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.704 177.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.85 -30.35 67.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.113 2.542 . . . . 0.0 113.422 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -76.69 -24.15 53.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.143 -178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -140.28 72.95 1.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.424 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.2 mt -87.81 125.73 41.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.936 0.398 . . . . 0.0 111.198 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -106.4 117.53 34.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.43 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.415 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 59.4 mt -93.83 109.12 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 173.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -110.64 100.66 9.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.937 0.875 . . . . 0.0 110.629 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -66.98 -6.89 18.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.505 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -81.71 -27.89 33.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.718 0.294 . . . . 0.0 111.209 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.4 -24.38 18.09 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.435 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 36.9 mt -61.04 123.27 17.15 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.618 176.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.8 mptt -69.92 148.21 96.22 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.653 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -44.75 -33.59 7.29 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.507 2.138 . . . . 0.0 113.257 175.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.2 t -60.84 -46.7 89.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.496 0.189 . . . . 0.0 110.726 178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.5 m -65.38 -48.11 74.02 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.76 -37.85 74.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.832 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.578 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 8.7 tpt180 -71.5 -49.48 40.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.828 178.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.513 ' HG3' HD13 ' A' ' 36' ' ' ILE . 6.8 tp10 -56.28 -48.43 76.63 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.175 0.512 . . . . 0.0 110.164 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 71' ' ' VAL . 96.1 mt -57.14 -58.24 9.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.312 178.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.442 ' O ' HG22 ' A' ' 71' ' ' VAL . 28.8 tt0 -55.04 -47.85 74.23 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.947 0.403 . . . . 0.0 111.004 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -58.04 -36.34 72.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.63 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -80.06 -46.07 17.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.835 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.465 HG11 ' CD1' ' A' ' 25' ' ' LEU . 17.0 m -64.1 -39.41 85.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.14 0.495 . . . . 0.0 110.636 -175.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.589 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 23.9 p -72.14 -34.0 68.2 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.532 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.5 p -67.98 -17.71 64.52 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.204 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.652 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.7 t -91.41 -54.26 3.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.663 177.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.433 ' HG ' HD22 ' A' ' 25' ' ' LEU . 65.7 mt -77.03 -30.34 55.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -173.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.589 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.8 mtp180 -82.09 -5.12 58.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.148 0.499 . . . . 0.0 110.297 177.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 C--N 1.324 -0.513 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.367 174.464 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 pt . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.956 0.408 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . 0.415 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 12.5 t -95.73 117.19 39.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.174 -177.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 26.9 mttm -106.26 89.02 2.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -101.0 137.29 39.56 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.459 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 92.4 mttt . . . . . 0 C--N 1.317 -0.83 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.039 -177.602 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.1 m . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 120.829 0.347 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -69.75 146.67 95.87 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.84 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.01 126.24 19.78 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.865 2.377 . . . . 0.0 112.173 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' MET . . . . . 0.406 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 24.6 mmt -57.08 134.77 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.703 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 m -88.67 174.77 7.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.51 -54.92 40.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -165.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -51.65 -40.06 59.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.657 0.265 . . . . 0.0 111.695 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.66 -47.33 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.491 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.5 mttt -58.52 -41.96 86.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.943 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.421 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 ttp180 -63.48 -46.63 85.29 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.334 177.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' A' ' 68' ' ' GLU . 0.5 OUTLIER -60.89 -50.92 71.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.412 178.536 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 95.7 p -58.74 -37.02 75.29 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.975 0.417 . . . . 0.0 110.866 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 98.1 mt -70.3 -40.52 74.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.653 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.532 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 63.7 m-20 -67.25 -37.2 83.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.45 ' HA ' HD12 ' A' ' 25' ' ' LEU . 87.4 mt -62.28 -40.11 86.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.898 0.38 . . . . 0.0 110.719 176.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -72.23 -28.96 63.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.098 0.475 . . . . 0.0 110.563 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.489 ' CB ' HD13 ' A' ' 75' ' ' LEU . 46.6 mttp -62.13 -39.0 91.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.692 171.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 96.0 mt -64.47 141.43 98.21 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.787 -175.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.4 Cg_endo -82.77 172.08 11.41 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.479 2.786 . . . . 0.0 112.717 178.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.11 -39.41 63.57 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.886 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -48.34 -59.53 3.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.73 0.776 . . . . 0.0 111.171 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -77.42 -29.32 52.92 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.022 -176.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.6 -29.85 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.801 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.8 -35.06 80.45 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.84 175.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -80.69 -38.92 28.09 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 122.749 -0.266 . . . . 0.0 110.748 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.437 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -55.34 -53.76 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 110.548 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.411 HG21 HD11 ' A' ' 52' ' ' ILE . 13.5 p -63.78 -30.92 51.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.672 -179.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -66.59 -41.26 88.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.101 177.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 66.0 mt -63.08 -43.17 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.048 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.4 mt -64.39 -62.29 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.937 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -60.67 -35.43 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.2 t -74.02 -36.81 64.47 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.264 -176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.472 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 11.0 mpt_? -77.73 -31.84 52.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.271 176.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 21.0 mm-40 -117.91 86.37 25.04 Favored Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.473 -176.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.26 -9.72 24.79 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.299 1.999 . . . . 0.0 112.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.4 m -84.47 -3.87 58.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 110.393 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.8 mt -114.29 29.29 8.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.522 0.677 . . . . 0.0 109.325 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -82.19 -9.96 59.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 -172.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -100.6 24.12 9.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.379 0.609 . . . . 0.0 110.355 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.6 p -77.87 103.35 7.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.337 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -57.61 119.72 35.28 Favored Pre-proline 0 CA--C 1.52 -0.192 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.804 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.408 ' HA ' HD13 ' A' ' 52' ' ' ILE . 86.4 Cg_exo -51.59 -25.31 19.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 123.546 2.83 . . . . 0.0 113.832 -176.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.592 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 18.5 m-20 -77.67 -28.33 51.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.433 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -143.03 76.64 1.54 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.411 HD11 HG21 ' A' ' 34' ' ' VAL . 41.9 mt -87.97 129.51 39.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.069 -176.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.519 ' HG2' ' HZ3' ' B' ' 206' ' ' LYS . 2.2 mp0 -108.44 123.93 49.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.214 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . 0.419 HD11 HG22 ' A' ' 54' ' ' ILE . 17.9 mt -95.74 108.67 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 175.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.439 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 13.0 p-10 -104.06 97.65 7.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.008 0.908 . . . . 0.0 110.852 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -71.57 -0.42 10.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.983 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -84.93 -22.13 29.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.84 0.352 . . . . 0.0 110.582 -178.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.7 p -102.52 -25.02 13.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.978 0.418 . . . . 0.0 110.078 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 37.7 mt -57.06 131.83 51.08 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.784 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.408 ' HZ1' ' CD ' ' A' ' 41' ' ' GLU . 18.2 mtmm -75.89 150.55 83.79 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.32 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -45.8 -41.63 19.82 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 113.31 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.8 p -57.72 -48.11 80.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -62.82 -47.51 83.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.157 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.0 mt -57.96 -40.59 80.93 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.987 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -68.36 -46.52 69.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.271 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -68.13 -39.71 82.67 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.065 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.608 ' O ' HG13 ' A' ' 71' ' ' VAL . 82.3 mt -57.04 -54.16 49.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 174.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.429 ' HB2' HD13 ' A' ' 18' ' ' LEU . 23.3 tt0 -57.46 -47.72 81.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.514 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -63.76 -27.78 69.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.159 -176.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -79.43 -51.67 9.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.11 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.608 HG13 ' O ' ' A' ' 67' ' ' LEU . 5.3 m -66.79 -36.24 76.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.712 0.291 . . . . 0.0 110.878 -173.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.1 p -72.37 -38.28 68.57 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.638 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.1 p -62.18 -24.19 67.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.433 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 27.7 t -91.03 -49.95 6.13 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.507 -179.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 21' ' ' ASP . 71.9 mt -83.23 -21.19 33.47 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -172.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 72' ' ' THR . 35.2 mtp180 -85.96 0.54 52.98 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.412 0.625 . . . . 0.0 109.789 175.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.9 tttm . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.673 169.437 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--O 1.233 0.205 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.6 t -91.74 109.75 21.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.885 0.374 . . . . 0.0 110.657 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 206' ' ' LYS . . . . . 0.519 ' HZ3' ' HG2' ' A' ' 53' ' ' GLU . 8.3 tppt? -99.18 83.56 2.88 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 175.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -99.09 158.29 15.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.116 0.484 . . . . 0.0 110.637 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 208' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 44.4 tttp . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.233 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 120.762 0.315 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -99.28 -44.23 6.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.25 0.548 . . . . 0.0 110.942 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.48 -55.67 30.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.101 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.31 -21.66 60.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.206 0.527 . . . . 0.0 110.703 -175.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -75.53 -25.61 57.34 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.774 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -95.57 -43.19 8.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.339 177.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.3 m -105.42 101.01 10.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.358 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -75.77 147.09 80.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.653 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.5 146.8 96.71 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.4 2.734 . . . . 0.0 112.906 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.419 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.72 129.08 34.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.879 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.0 p -72.55 177.45 4.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 177.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.492 ' OH ' ' HA ' ' B' ' 202' ' ' SER . 2.4 t80 -60.7 -46.74 89.22 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.014 -177.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -54.19 -44.26 71.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.015 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -61.39 -46.77 88.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.464 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 10' ' ' MET . 90.7 mttt -62.41 -34.21 76.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.549 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.9 ttp85 -68.42 -40.96 81.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.973 0.416 . . . . 0.0 110.08 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.44 -49.08 79.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.022 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.769 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -63.19 -34.83 78.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.214 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.3 t -63.91 -34.18 77.38 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.048 0.452 . . . . 0.0 110.449 173.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.9 mt -79.26 -41.47 28.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.438 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.769 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.9 p30 -65.77 -42.91 90.24 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.143 178.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.431 ' HA ' HD12 ' A' ' 25' ' ' LEU . 45.1 mt -59.33 -37.32 68.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 177.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -71.34 -23.92 62.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.626 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.409 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 51.2 mtpt -83.45 -14.25 52.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.054 0.454 . . . . 0.0 110.281 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.463 HD13 HG11 ' A' ' 71' ' ' VAL . 92.2 mt -79.76 137.73 54.37 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.448 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 95.1 Cg_endo -80.98 172.55 12.92 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 123.183 2.589 . . . . 0.0 113.156 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.84 -44.64 49.34 Favored Glycine 0 CA--C 1.519 0.321 0 O-C-N 123.361 0.413 . . . . 0.0 113.701 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -50.16 -57.84 6.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.394 0.616 . . . . 0.0 111.175 -179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.635 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -74.17 -25.53 59.77 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.182 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.55 -26.89 68.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.124 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.44 93.34 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.208 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -76.61 -37.57 56.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.267 177.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.445 ' O ' HG13 ' A' ' 37' ' ' ILE . 57.4 t -59.09 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.619 177.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 15.0 p -63.43 -28.72 45.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.533 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -67.46 -42.17 83.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.216 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.69 -46.35 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 33' ' ' VAL . 57.1 mt -60.1 -55.63 22.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.44 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.439 HE21 ' HB2' ' A' ' 47' ' ' SER . 4.0 mt-30 -61.38 -40.98 96.32 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.5 t -74.28 -30.21 61.99 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.305 -0.247 . . . . 0.0 111.539 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.401 ' HD3' ' OE2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -82.3 -28.86 31.46 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.544 -0.463 . . . . 0.0 110.313 174.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -116.23 83.34 12.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.716 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.58 -16.01 52.07 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.41 2.074 . . . . 0.0 112.783 -178.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.2 t -74.01 -22.36 59.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 109.952 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.2 mt -96.42 25.98 4.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.395 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -63.12 -25.05 68.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -89.46 36.92 0.85 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.459 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.439 ' HB2' HE21 ' A' ' 38' ' ' GLN . 70.1 m -80.12 88.83 5.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 174.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -62.61 124.5 83.27 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.965 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_exo -53.01 -23.09 20.5 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.463 2.775 . . . . 0.0 113.904 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.08 -23.37 48.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -147.66 72.62 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.259 0.224 . . . . 0.0 110.792 -174.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.0 mt -90.95 122.12 42.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.533 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -99.9 140.61 33.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.639 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 49.3 mt -112.54 107.69 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.51 92.66 4.14 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 122.23 1.014 . . . . 0.0 110.103 176.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -61.52 -15.93 42.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.229 -174.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -75.15 -22.32 58.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.495 -174.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -96.9 -26.72 14.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.0 mt -58.61 123.88 17.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.848 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.06 150.64 97.47 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.636 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -46.61 -29.5 7.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.483 2.122 . . . . 0.0 112.542 173.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 t -56.73 -55.36 35.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -63.77 -46.16 86.52 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.414 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -59.17 -37.2 76.77 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.093 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -73.25 -45.08 57.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.973 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.401 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 29.9 mt-10 -66.47 -38.29 87.0 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.679 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.464 ' O ' HG13 ' A' ' 71' ' ' VAL . 77.3 mt -60.36 -56.83 16.69 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.363 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -55.36 -41.83 73.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -58.43 -36.96 74.43 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.302 0.572 . . . . 0.0 110.534 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -82.77 -45.74 14.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.87 -175.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.464 HG13 ' O ' ' A' ' 67' ' ' LEU . 11.4 m -63.19 -36.01 74.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.04 0.448 . . . . 0.0 110.403 -177.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 30.6 p -71.75 -39.95 69.69 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.335 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -64.82 -21.56 66.81 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.611 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.635 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 29.3 t -91.14 -53.14 4.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.762 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.459 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.2 mt -79.51 -35.68 39.7 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -171.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.535 ' HB2' ' O ' ' A' ' 72' ' ' THR . 95.2 mtt180 -67.89 -31.43 71.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -83.84 -49.85 8.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.033 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -128.01 97.78 4.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.014 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -67.32 -21.9 65.64 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.499 . . . . 0.0 110.774 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -134.36 86.17 36.26 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.12 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.29 -12.92 36.42 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.864 2.376 . . . . 0.0 111.815 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' A' ' 26' ' ' PRO . 10.5 pt20 -117.13 159.9 21.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.217 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.156 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.799 -177.524 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.709 0.29 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 93.7 mt -75.56 121.12 21.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.346 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -64.15 99.45 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.127 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' SER . . . . . 0.492 ' HA ' ' OH ' ' A' ' 12' ' ' TYR . 26.8 m -100.1 164.73 11.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 7.4 p -73.21 74.85 1.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.581 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 47.5 mm -76.88 120.01 26.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 174.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 4.4 t -100.81 149.87 5.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.13 -172.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -134.17 127.89 32.92 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -140.64 151.6 44.73 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.149 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -97.5 131.59 43.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.287 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 17.3 ttpp -113.58 119.2 42.07 Favored Pre-proline 0 C--N 1.318 -0.776 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.73 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -58.17 147.0 86.11 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.606 2.204 . . . . 0.0 111.625 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 76.4 mt 66.67 95.56 0.05 OUTLIER Pre-proline 0 C--O 1.235 0.315 0 O-C-N 123.871 0.732 . . . . 0.0 111.41 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.54 80.4 2.3 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.459 2.106 . . . . 0.0 112.144 178.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 33.8 tp -71.95 -37.51 69.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.151 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 27.5 p -96.95 75.06 2.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.003 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -108.81 108.12 60.53 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.82 151.89 81.52 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.568 2.179 . . . . 0.0 112.606 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.414 -1.215 . . . . 0.0 111.858 179.586 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 120.696 0.284 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -76.09 -4.85 43.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.43 -176.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -61.85 -48.87 78.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.381 -179.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.25 -26.93 65.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 0.0 110.492 -176.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -67.11 -30.94 71.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.0 -177.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -109.28 -29.82 8.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.947 0.403 . . . . 0.0 111.019 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.492 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 62.5 m -109.93 99.58 8.68 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.959 -177.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.78 149.79 64.55 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.79 135.63 53.19 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 123.185 2.59 . . . . 0.0 112.42 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -70.04 135.02 48.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.5 p -76.76 176.18 8.71 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -61.86 -46.85 87.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.372 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -54.84 -44.66 74.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.112 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -64.7 -46.23 83.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.186 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -58.03 -44.24 87.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.179 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -63.86 -43.09 97.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.875 0.369 . . . . 0.0 110.275 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -57.62 -47.27 82.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.186 176.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.413 HD13 ' HB2' ' A' ' 68' ' ' GLU . 0.7 OUTLIER -59.5 -48.07 83.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.036 179.172 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.631 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 59.7 p -60.87 -35.87 77.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.796 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.9 -35.93 67.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.954 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.51 ' O ' HD12 ' A' ' 75' ' ' LEU . 1.1 m-20 -70.05 -42.23 73.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.427 177.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.423 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.1 mt -56.72 -38.22 56.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.318 0.58 . . . . 0.0 110.646 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.1 -25.25 64.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.576 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -82.11 -15.75 52.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.057 0.456 . . . . 0.0 110.637 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 22' ' ' ILE . 92.1 mt -77.41 134.4 66.5 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.531 -176.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.462 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 92.1 Cg_endo -80.45 171.27 14.97 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 123.042 2.495 . . . . 0.0 113.252 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.3 -46.24 44.15 Favored Glycine 0 CA--C 1.52 0.365 0 O-C-N 123.377 0.423 . . . . 0.0 114.048 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -47.75 -51.99 20.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.09 0.471 . . . . 0.0 111.684 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.553 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -79.64 -30.13 41.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.088 -174.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.48 -27.07 68.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.52 -31.27 79.13 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.058 -0.591 . . . . 0.0 112.177 174.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.411 ' O ' HG13 ' A' ' 36' ' ' ILE . 17.1 tpp180 -81.69 -41.69 20.96 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.799 -0.236 . . . . 0.0 110.377 177.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 80.2 t -56.22 -54.12 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.84 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.1 -31.46 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.582 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.64 -41.68 92.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.867 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.2 mt -64.25 -50.98 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.107 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' VAL . 43.2 mt -56.24 -59.88 2.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.161 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -63.14 -34.4 77.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.8 m -77.69 -33.08 53.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 122.026 -0.421 . . . . 0.0 111.754 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -77.13 -30.12 55.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.093 0.473 . . . . 0.0 109.966 174.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 35.0 mm-40 -115.52 84.23 11.91 Favored Pre-proline 0 N--CA 1.446 -0.665 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.41 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.48 -13.97 40.89 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.398 2.066 . . . . 0.0 112.352 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.2 t -79.56 -11.15 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.134 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.0 mt -105.76 32.29 4.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.434 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -80.99 -1.76 45.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.235 0.54 . . . . 0.0 110.496 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -97.4 17.13 18.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.682 0.754 . . . . 0.0 109.659 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.9 m -75.86 95.74 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.903 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -54.82 122.9 43.31 Favored Pre-proline 0 C--N 1.331 -0.205 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 173.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.19 -16.88 23.41 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.889 2.393 . . . . 0.0 112.459 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -82.55 -36.79 25.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.247 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -131.92 62.02 1.64 Allowed 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.894 -176.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.503 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 24.0 mt -74.0 119.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.173 0.511 . . . . 0.0 111.458 -175.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -103.99 131.37 51.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.342 178.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 39.8 mt -106.87 109.67 28.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.27 101.92 11.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.101 0.953 . . . . 0.0 110.543 176.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.81 -6.9 44.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.312 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.74 -30.54 45.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.767 0.317 . . . . 0.0 110.765 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.5 p -90.16 -26.07 20.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.95 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.44 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 38.4 mt -59.32 127.38 31.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.637 176.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -72.91 148.17 89.21 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.854 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -43.79 -36.2 7.51 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.567 2.178 . . . . 0.0 113.201 175.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.491 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 33.5 t -54.6 -56.96 13.51 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 175.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -59.18 -47.8 83.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.456 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.5 mt -57.18 -40.37 77.21 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.115 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.492 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 18.3 tpt180 -71.1 -46.92 60.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.023 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 62' ' ' SER . 41.5 mt-10 -65.61 -38.64 90.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.408 . . . . 0.0 110.458 -177.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 71' ' ' VAL . 93.2 mt -62.0 -55.97 23.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.244 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.413 ' HB2' HD13 ' A' ' 18' ' ' LEU . 18.8 tt0 -53.83 -47.21 71.16 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.484 179.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 69' ' ' ARG . 35.2 ttp180 -52.7 -42.45 64.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.329 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -79.48 -47.84 14.93 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.832 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.1 m -63.79 -35.33 72.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.955 0.407 . . . . 0.0 110.381 -176.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 40.6 p -75.73 -36.69 59.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.828 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.3 p -66.56 -19.32 65.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.749 0.309 . . . . 0.0 110.601 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.553 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 24.4 t -90.44 -51.1 5.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.609 178.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.51 HD12 ' O ' ' A' ' 21' ' ' ASP . 81.3 mt -79.87 -36.8 36.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -173.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 72' ' ' THR . 46.1 mtp180 -79.18 -4.74 51.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.105 0.479 . . . . 0.0 110.711 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -102.16 -34.22 9.36 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -148.57 105.77 3.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.412 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -54.18 -38.14 65.26 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.962 -174.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -127.38 96.46 33.43 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 172.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -56.31 115.03 2.18 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.969 2.446 . . . . 0.0 112.65 -178.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -138.17 127.76 24.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.027 -178.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 CA-C-O 118.434 -0.793 . . . . 0.0 109.845 177.898 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.407 0.146 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -139.23 156.43 47.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.773 0.32 . . . . 0.0 110.423 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -100.67 90.43 4.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 19.2 m -74.76 159.81 31.51 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.002 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 14.9 m -81.0 83.54 6.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.53 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 44.3 mm -75.1 133.11 32.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.08 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.631 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 88.8 t -104.88 122.91 58.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.419 -177.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 16.5 ttmm -107.09 117.34 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.507 171.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -127.79 141.88 51.46 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.528 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 27.0 mtpp -96.24 126.67 41.62 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.695 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -114.06 84.03 8.53 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.143 -177.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 5.2 Cg_exo -78.51 115.59 3.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.282 2.655 . . . . 0.0 113.086 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 50.7 tp -116.37 110.78 42.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.527 175.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.59 103.72 1.02 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.439 2.093 . . . . 0.0 112.414 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 80.5 mt -87.21 -15.99 36.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.132 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 5.5 p -73.76 86.13 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.593 176.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -138.45 122.3 11.41 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.943 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 178.65 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.389 2.059 . . . . 0.0 111.7 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.053 -1.415 . . . . 0.0 111.179 178.961 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 120.541 0.21 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -98.72 -32.7 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -177.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.46 -43.03 82.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.513 0.197 . . . . 0.0 110.545 -175.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -73.23 -16.68 61.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.761 0.315 . . . . 0.0 110.997 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -78.59 -43.85 25.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.478 ' HE2' ' SG ' ' A' ' 7' ' ' CYS . 0.4 OUTLIER -71.38 -49.64 40.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.209 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.478 ' SG ' ' HE2' ' A' ' 6' ' ' LYS . 55.8 m -99.0 98.02 9.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.291 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.03 154.33 60.55 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.609 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.59 128.92 24.77 Favored 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 123.172 2.581 . . . . 0.0 112.14 -176.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.449 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -61.34 130.06 44.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.189 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.8 p -73.65 173.88 9.13 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.75 -47.3 86.23 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.725 -174.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -53.7 -41.95 67.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.489 . . . . 0.0 111.081 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -67.56 -46.96 71.19 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.121 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.449 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.3 mttt -58.73 -42.22 88.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.259 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -62.0 -44.41 96.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.909 0.385 . . . . 0.0 110.336 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.99 -41.41 78.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.426 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.834 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 1.5 mt -67.0 -36.04 81.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.859 -176.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.4 p -65.74 -29.13 69.61 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.867 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.22 -42.41 31.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.834 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.4 p30 -67.85 -45.67 73.94 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.196 -0.201 . . . . 0.0 110.974 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' LEU . 36.0 mt -57.25 -34.21 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.365 0.603 . . . . 0.0 110.17 177.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -71.39 -29.37 64.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.434 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 55.4 mtpt -78.92 -22.37 45.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.035 0.445 . . . . 0.0 110.568 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.485 HD22 ' HG ' ' A' ' 75' ' ' LEU . 86.6 mt -72.51 138.76 80.79 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.521 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 48.9 Cg_endo -83.81 172.63 9.85 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.475 2.783 . . . . 0.0 112.799 178.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.03 -44.38 62.32 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.548 -0.358 . . . . 0.0 113.466 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.3 mp0 -46.52 -52.06 14.14 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.615 0.721 . . . . 0.0 111.31 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.557 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.2 mptp? -83.51 -25.7 30.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.816 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.07 -27.08 68.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.311 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.78 92.08 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.046 -0.597 . . . . 0.0 111.625 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -76.74 -42.86 39.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.561 0.22 . . . . 0.0 110.72 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.445 HG11 HD22 ' A' ' 67' ' ' LEU . 59.9 t -56.12 -52.07 54.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.961 0.41 . . . . 0.0 110.731 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.435 ' CG2' HD11 ' A' ' 52' ' ' ILE . 8.0 p -65.14 -32.25 57.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.625 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -63.61 -42.43 98.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 79.3 mt -62.79 -49.06 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.316 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.405 HG23 HD22 ' A' ' 59' ' ' LEU . 51.1 mt -61.51 -56.97 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 179.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -61.51 -32.97 73.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.9 t -80.16 -37.2 33.89 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.219 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.566 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -72.8 -35.6 67.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 120.972 0.415 . . . . 0.0 110.172 175.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.514 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 25.4 mm-40 -114.12 84.63 9.26 Favored Pre-proline 0 N--CA 1.442 -0.833 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.969 -175.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.2 -13.31 39.32 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.334 2.023 . . . . 0.0 112.33 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.0 m -79.06 -7.2 57.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.238 0.542 . . . . 0.0 110.353 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -110.88 25.62 11.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.32 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.77 -16.13 60.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.912 0.387 . . . . 0.0 110.844 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.72 28.14 1.6 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.86 0.362 . . . . 0.0 111.061 177.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 p -80.05 97.71 6.93 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -57.3 123.93 63.79 Favored Pre-proline 0 CA--C 1.516 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.95 -21.23 25.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 123.075 2.517 . . . . 0.0 113.15 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.61 -22.08 37.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.06 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -143.64 75.41 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.307 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.435 HD11 ' CG2' ' A' ' 34' ' ' VAL . 28.9 mt -92.05 121.81 42.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.648 0.261 . . . . 0.0 111.091 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -104.21 137.34 42.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.737 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 54.2 mt -110.83 109.98 30.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.632 0.253 . . . . 0.0 110.58 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -110.53 98.78 7.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.933 0.873 . . . . 0.0 110.474 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -64.66 -16.36 62.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.582 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -74.16 -27.51 60.87 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.659 -176.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.08 -26.63 17.38 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.921 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.405 HD22 HG23 ' A' ' 37' ' ' ILE . 29.8 mt -56.53 128.64 37.19 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.238 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.514 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 24.0 mttm -70.84 149.23 95.05 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.822 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -46.46 -38.84 21.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.16 1.907 . . . . 0.0 112.35 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.8 m -56.61 -50.45 71.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.992 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.404 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.3 m -62.14 -48.22 81.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.395 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.02 -34.96 70.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -73.76 -50.54 20.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.128 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.566 ' OE1' ' HD3' ' A' ' 40' ' ' ARG . 40.9 mt-10 -62.41 -40.76 97.59 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.712 0.292 . . . . 0.0 110.779 -178.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.2 mt -57.1 -60.35 3.73 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.357 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.568 ' OE2' HG21 ' A' ' 72' ' ' THR . 6.1 tp10 -51.92 -52.35 50.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.346 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -55.9 -36.5 67.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.051 0.453 . . . . 0.0 110.941 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.13 -48.19 18.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.845 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.476 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -63.55 -36.19 75.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.825 0.345 . . . . 0.0 110.62 -175.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.568 HG21 ' OE2' ' A' ' 68' ' ' GLU . 0.9 OUTLIER -67.74 -39.26 84.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.1 p -65.62 -23.15 66.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.812 0.339 . . . . 0.0 110.573 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.557 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 49.1 t -90.01 -47.11 8.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.973 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.485 ' HG ' HD22 ' A' ' 25' ' ' LEU . 74.8 mt -87.8 -44.17 11.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' THR . 90.4 mtt180 -66.83 -26.03 66.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.803 0.335 . . . . 0.0 111.208 -176.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -94.1 2.07 56.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.17 178.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -141.23 -144.3 0.16 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.407 ' HG3' ' N ' ' A' ' 80' ' ' LYS . 30.9 ptt180 -150.71 -51.73 0.13 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.627 0.251 . . . . 0.0 110.533 176.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.407 ' N ' ' HG3' ' A' ' 79' ' ' ARG . 54.9 tttm 178.33 122.91 0.2 Allowed Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.429 ' HG2' ' HG3' ' A' ' 26' ' ' PRO . 76.8 Cg_exo -48.63 111.87 0.53 Allowed 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.963 2.442 . . . . 0.0 112.383 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.54 -52.88 15.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.262 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.241 178.916 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.827 0.346 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 56.3 tp -132.18 -48.11 0.92 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -158.01 96.27 1.45 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.404 0.621 . . . . 0.0 111.051 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 51.5 m -87.57 56.47 3.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.107 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 37.4 m 61.31 57.96 2.28 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.732 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.453 HD11 ' N ' ' B' ' 204' ' ' ILE . 2.3 mp -79.4 108.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 175.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.33 163.24 2.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.158 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' B' ' 206' ' ' LYS . 0.0 OUTLIER -159.24 141.85 14.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.114 169.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -140.93 159.62 41.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.896 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -104.98 128.86 53.46 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -119.86 85.82 34.82 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.053 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -61.62 -52.26 3.28 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.559 2.173 . . . . 0.0 111.254 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 33.7 tp 48.59 70.16 2.26 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -62.64 143.65 92.87 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.513 2.142 . . . . 0.0 111.708 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 8.6 mp 59.93 53.91 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.814 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 91.6 m -65.61 -37.1 85.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.412 0.625 . . . . 0.0 109.685 176.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -80.99 143.19 52.82 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.739 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.06 59.87 5.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.629 2.219 . . . . 0.0 112.275 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.753 -1.026 . . . . 0.0 111.664 179.357 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.3 m . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.718 0.294 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -60.21 -36.08 76.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.419 ' OE2' ' HD3' ' A' ' 8' ' ' LYS . 15.0 tp10 -64.0 -28.38 69.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.971 0.415 . . . . 0.0 111.001 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 -71.82 -35.83 70.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.1 0.476 . . . . 0.0 110.521 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.5 -45.72 9.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.87 -57.57 3.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.603 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.8 m 62.34 98.29 0.03 OUTLIER 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.838 0.711 . . . . 0.0 110.83 -175.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.419 ' HD3' ' OE2' ' A' ' 3' ' ' GLU . 0.5 OUTLIER -66.12 145.46 99.0 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.916 -179.782 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -64.75 152.63 81.32 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.901 2.4 . . . . 0.0 112.066 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.3 mmt -85.86 130.51 34.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.519 -178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.41 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 39.9 p -77.8 178.2 7.57 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 175.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.29 -49.59 77.27 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.728 -174.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.13 -49.63 63.33 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 109.711 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.41 -44.93 96.29 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.842 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 11' ' ' SER . 89.7 mttt -60.38 -41.81 94.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.402 177.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -64.73 -41.54 95.88 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.826 0.346 . . . . 0.0 110.396 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.49 -47.56 81.58 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.546 HD22 ' OD1' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -61.91 -41.06 97.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.731 178.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.9 p -63.81 -25.32 68.12 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.211 -0.93 . . . . 0.0 110.449 176.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.9 mt -84.73 -42.99 14.71 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.448 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.546 ' OD1' HD22 ' A' ' 18' ' ' LEU . 1.1 p30 -67.4 -41.36 85.06 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 121.258 -0.177 . . . . 0.0 110.785 177.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -58.43 -40.57 78.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.015 0.436 . . . . 0.0 110.269 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -68.34 -30.92 69.99 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -62.07 -35.37 78.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.978 0.418 . . . . 0.0 111.346 173.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.529 ' CD1' HG11 ' A' ' 71' ' ' VAL . 95.0 mt -68.35 135.79 91.06 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.549 -0.751 . . . . 0.0 112.313 -172.011 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.44 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.2 Cg_endo -80.83 172.09 13.59 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.342 2.695 . . . . 0.0 112.803 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.52 -43.46 52.69 Favored Glycine 0 C--O 1.237 0.332 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.378 -175.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -48.62 -55.87 10.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.522 0.677 . . . . 0.0 111.148 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.578 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -80.37 -27.06 38.3 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.445 -174.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.564 ' O ' HG21 ' A' ' 34' ' ' VAL . 11.0 mt -62.64 -27.75 69.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.626 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.574 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.419 ' O ' HG13 ' A' ' 36' ' ' ILE . 12.6 tpp180 -66.24 -41.52 89.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.671 0.272 . . . . 0.0 110.675 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.507 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.7 t -56.85 -52.14 58.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.88 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.564 HG21 ' O ' ' A' ' 30' ' ' LEU . 22.2 t -64.17 -36.84 78.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.455 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -59.45 -41.63 90.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.206 177.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.1 mt -66.73 -48.69 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.24 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 33' ' ' VAL . 55.0 mt -58.88 -55.83 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.036 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -62.3 -34.1 75.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.3 t -78.28 -36.13 47.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -176.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.605 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 5.9 mpt_? -80.32 -27.88 38.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.424 177.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.63 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 60.0 mm-40 -114.21 87.05 12.66 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.851 178.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.12 -13.1 35.79 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.125 1.883 . . . . 0.0 112.109 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.9 t -72.7 -20.95 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.232 0.539 . . . . 0.0 109.803 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.1 mt -104.1 33.82 3.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.228 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -72.74 -17.65 61.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.505 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.71 41.86 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.778 0.799 . . . . 0.0 110.062 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.9 m -88.51 91.01 8.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.424 177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -60.04 123.22 71.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.19 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_exo -56.24 -19.04 26.09 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.253 2.635 . . . . 0.0 113.147 -179.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.19 -27.82 38.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -146.85 78.67 1.5 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.921 -176.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.466 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 23.2 mt -92.25 125.74 44.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.205 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -104.55 119.63 39.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.651 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.415 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 48.2 mt -96.87 109.42 23.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.238 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.401 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 17.0 p-10 -109.39 98.62 7.99 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.931 0.872 . . . . 0.0 110.078 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -68.89 -0.35 5.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.802 -175.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -85.6 -24.69 27.06 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.95 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.2 p -101.78 -26.01 13.62 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.457 HD23 ' HG3' ' A' ' 41' ' ' GLU . 31.3 mt -53.8 128.78 31.2 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.647 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.63 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 23.1 mttm -71.91 150.99 92.97 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.657 178.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -47.11 -36.5 21.43 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.296 1.997 . . . . 0.0 112.426 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.43 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 25.6 t -54.4 -54.43 40.73 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.0 -49.62 76.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.668 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -57.38 -37.64 72.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.306 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.6 -45.97 23.55 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.085 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.7 mt-10 -63.92 -36.66 84.67 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.789 0.328 . . . . 0.0 110.457 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.432 HD22 HG11 ' A' ' 33' ' ' VAL . 83.6 mt -62.2 -56.1 22.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.116 174.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 71' ' ' VAL . 30.0 tt0 -55.16 -46.83 75.76 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.144 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -63.03 -31.93 73.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.795 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.412 ' HH ' ' CB ' ' A' ' 29' ' ' LYS . 68.0 t80 -78.53 -47.78 16.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.612 -179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.529 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.7 m -63.12 -42.47 96.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.14 0.495 . . . . 0.0 110.471 -176.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.426 ' H ' HG22 ' A' ' 71' ' ' VAL . 24.7 p -63.91 -36.66 84.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.933 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 82.9 p -67.73 -24.23 65.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.578 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.3 t -91.14 -32.35 15.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.433 -177.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 21' ' ' ASP . 28.1 mt -97.79 -43.05 7.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 20.9 mtp180 -71.46 -10.7 60.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 110.377 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -106.76 -28.14 10.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.283 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -151.53 75.38 1.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.84 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.447 ' HD2' ' H ' ' A' ' 79' ' ' ARG . 0.1 OUTLIER -60.99 130.03 44.39 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.784 0.326 . . . . 0.0 110.158 176.016 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 51.9 tptt 58.15 74.89 0.58 Allowed Pre-proline 0 C--O 1.236 0.363 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.355 -172.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.41 97.48 1.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.084 2.523 . . . . 0.0 112.037 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -83.34 -30.83 27.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.412 0.625 . . . . 0.0 109.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.13 179.654 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.65 -18.17 42.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.057 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.89 29.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.674 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 32.4 p -172.07 156.26 3.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.847 0.356 . . . . 0.0 111.113 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 35.2 m -100.02 99.55 10.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.789 174.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 4.0 mp -74.21 124.46 31.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.415 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 26.9 t -104.9 105.31 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.337 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.2 ttmm -96.01 118.02 31.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.429 ' CZ ' HD21 ' A' ' 30' ' ' LEU . 10.3 p90 -131.75 137.32 48.15 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.67 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 59.0 mttm -85.7 111.4 20.08 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -73.11 121.32 84.81 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.293 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.92 143.82 86.46 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.494 2.129 . . . . 0.0 111.151 175.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 87.4 mt 60.7 65.37 2.11 Favored Pre-proline 0 C--N 1.329 -0.321 0 O-C-N 123.664 0.602 . . . . 0.0 111.351 -178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -63.79 -38.45 39.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.268 1.978 . . . . 0.0 111.301 176.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.31 71.14 4.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 174.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 5.8 t -69.52 121.39 16.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.489 0.661 . . . . 0.0 111.392 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . 0.447 ' HA ' ' HD3' ' B' ' 216' ' ' PRO . 12.5 pt20 -87.55 143.12 33.52 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.943 177.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' B' ' 215' ' ' GLN . 12.1 Cg_exo -70.67 77.22 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.976 2.451 . . . . 0.0 112.774 -178.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 119.005 -0.886 . . . . 0.0 111.406 177.293 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.665 ' O ' ' HG2' ' A' ' 4' ' ' GLU . 22.8 t . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -59.58 -35.59 74.57 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.16 -36.34 77.35 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.703 0.229 . . . . 0.0 111.585 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.665 ' HG2' ' O ' ' A' ' 1' ' ' SER . 11.1 pt-20 -70.96 -27.45 63.75 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 110.529 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -86.12 -28.21 24.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.402 0.62 . . . . 0.0 110.385 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -70.05 -40.87 74.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.451 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 m -84.05 99.35 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.382 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -75.94 145.19 77.25 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.584 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.9 124.34 13.41 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.494 2.129 . . . . 0.0 110.962 176.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.491 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.2 mmt -57.6 128.7 38.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 p -73.07 175.61 6.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.892 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.311 -174.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -56.3 -40.18 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.158 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.11 -46.4 81.16 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.719 178.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.491 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.0 mttt -60.98 -39.56 90.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.394 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -64.2 -44.74 91.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.38 -44.24 88.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.822 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.93 -39.89 79.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.819 -176.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.471 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 87.5 p -63.48 -25.77 68.41 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.715 -0.615 . . . . 0.0 110.328 175.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.548 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.2 mt -82.69 -44.76 15.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.164 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.822 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.6 p30 -62.09 -41.19 97.94 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.409 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.465 ' HA ' HD12 ' A' ' 25' ' ' LEU . 84.6 mt -62.94 -40.11 87.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.907 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -68.42 -28.5 67.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.962 0.411 . . . . 0.0 111.213 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.5 mtpp -78.25 -16.88 57.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 84.5 mt -79.3 132.56 62.35 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.619 -176.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 78.3 Cg_endo -76.69 172.18 16.68 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 123.199 2.599 . . . . 0.0 113.085 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.03 -45.54 50.98 Favored Glycine 0 C--N 1.334 0.442 0 O-C-N 123.301 0.376 . . . . 0.0 113.927 -172.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -49.79 -55.31 14.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.415 0.626 . . . . 0.0 110.993 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.584 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.9 mptp? -76.5 -31.43 57.71 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.944 -174.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mt -58.39 -31.05 67.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.489 175.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.25 -34.53 89.48 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.268 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -79.03 -39.91 32.79 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.584 0.23 . . . . 0.0 110.499 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.45 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.3 t -56.18 -55.09 20.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.685 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 12.0 p -63.63 -30.77 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.638 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -65.26 -41.77 93.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.908 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.8 mt -65.99 -41.22 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.903 177.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.486 HG23 HD22 ' A' ' 59' ' ' LEU . 72.8 mt -62.41 -60.56 2.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.218 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -65.83 -29.67 70.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -78.28 -38.79 41.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.05 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.447 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 9.6 mpt_? -76.4 -31.92 58.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.577 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.627 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 49.4 mm-40 -112.72 85.26 7.35 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.441 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.76 -12.26 30.71 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.363 2.042 . . . . 0.0 112.567 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -82.29 -5.27 58.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 0.0 110.574 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.5 mt -115.63 27.42 9.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.02 177.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -80.3 -17.14 52.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.252 0.549 . . . . 0.0 110.476 -174.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -92.85 20.66 6.34 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.807 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 66.8 m -68.78 105.26 2.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.177 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.648 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -50.6 120.86 13.57 Favored Pre-proline 0 N--CA 1.463 0.187 0 O-C-N 123.118 0.262 . . . . 0.0 110.534 171.576 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -59.08 -23.08 67.25 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.787 2.325 . . . . 0.0 111.556 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.477 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 21.9 m-20 -71.77 -35.96 70.21 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.643 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.648 ' HB2' ' OD1' ' A' ' 48' ' ' ASN . 20.5 mm-40 -138.64 72.1 1.4 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.035 0.379 . . . . 0.0 111.041 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.9 mt -82.79 120.7 34.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.009 0.433 . . . . 0.0 111.136 -178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.506 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 19.0 mm-40 -100.84 122.69 43.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.053 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.422 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.5 mt -91.04 108.76 20.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.952 175.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -107.19 98.85 8.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.163 0.982 . . . . 0.0 110.309 177.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -70.67 -1.04 10.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.137 -174.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -84.35 -29.28 26.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.932 0.396 . . . . 0.0 110.765 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.6 p -90.7 -32.21 16.27 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.486 HD22 HG23 ' A' ' 37' ' ' ILE . 33.3 mt -53.18 126.98 22.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.118 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.627 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 27.5 mttm -66.03 147.58 98.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.5 -30.44 21.19 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.362 2.042 . . . . 0.0 111.762 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 13.6 m -60.51 -52.23 66.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 174.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -61.13 -46.46 90.47 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.461 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.6 mt -58.87 -39.18 80.62 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.843 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -68.23 -48.24 65.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.075 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 62' ' ' SER . 17.3 mm-40 -66.48 -40.72 89.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.853 -178.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.436 HD22 HG11 ' A' ' 33' ' ' VAL . 75.6 mt -57.15 -55.39 35.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.682 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -54.08 -42.4 69.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.91 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -59.86 -43.03 94.92 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.326 0.584 . . . . 0.0 110.167 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -74.88 -46.55 35.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.969 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.456 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.2 m -63.9 -38.1 81.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.074 0.464 . . . . 0.0 110.727 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.46 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.7 p -72.8 -38.44 67.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.056 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.2 p -64.84 -19.57 65.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.584 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 31.4 t -90.84 -54.83 3.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.65 177.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.467 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.2 mt -78.85 -27.46 44.16 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 72' ' ' THR . 57.1 mtp180 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.621 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -94.83 -42.44 8.7 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.408 ' CG ' ' HA ' ' A' ' 81' ' ' PRO . 24.4 tptm -134.96 90.65 2.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.079 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -65.86 120.86 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 174.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 65.07 82.41 0.21 Allowed Pre-proline 0 C--O 1.235 0.339 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -170.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.408 ' HA ' ' CG ' ' A' ' 78' ' ' LYS . 11.5 Cg_exo -71.41 59.86 2.57 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.402 2.735 . . . . 0.0 113.04 -176.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -80.26 104.04 10.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.19 0.519 . . . . 0.0 109.944 174.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.414 -0.803 . . . . 0.0 109.868 178.872 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.74 0.305 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 64.5 mt -75.7 81.15 2.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.103 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -142.49 158.08 44.07 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.776 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 27.3 m -141.72 -163.67 1.62 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 19.1 m -111.84 118.17 34.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.661 0.267 . . . . 0.0 110.802 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 10.6 pt -85.16 154.61 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.619 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.471 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 61.3 t -121.12 113.82 41.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.633 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.506 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 19.5 ttmm -92.67 116.65 29.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -129.57 143.31 50.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.245 0.545 . . . . 0.0 110.55 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 44.1 mttp -94.61 114.75 26.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.355 176.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -79.17 112.59 29.26 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-O 120.808 0.337 . . . . 0.0 110.216 -177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.59 58.02 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.901 2.4 . . . . 0.0 112.444 -176.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 24.9 tp -154.89 87.32 3.36 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.887 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.52 -7.21 8.8 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.618 2.212 . . . . 0.0 113.149 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 2.9 mm? 57.57 48.69 13.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.437 -179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.9 t -148.26 150.63 34.03 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.318 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . 0.451 ' HB3' ' HD3' ' B' ' 216' ' ' PRO . 50.5 tt0 -169.77 -52.08 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.887 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . 0.451 ' HD3' ' HB3' ' B' ' 215' ' ' GLN . 96.3 Cg_endo -79.41 165.33 23.28 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.714 1.609 . . . . 0.0 112.418 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.247 -1.307 . . . . 0.0 111.47 178.183 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 m . . . . . 0 N--CA 1.479 0.989 0 CA-C-O 120.735 0.302 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -98.31 -42.96 7.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.14 -24.64 67.46 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -173.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.56 -21.72 66.5 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.088 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -86.47 -34.02 20.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.122 0.487 . . . . 0.0 110.467 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -77.97 -45.06 24.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.472 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.7 m 63.86 102.23 0.03 OUTLIER 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.628 0.58 . . . . 0.0 112.316 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.56 144.41 97.69 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 170.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.9 129.57 21.12 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.78 2.32 . . . . 0.0 110.993 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.537 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -64.67 128.14 34.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.567 -177.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.4 p -73.53 174.45 8.23 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.7 -46.7 88.28 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.475 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.84 -44.23 77.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.368 . . . . 0.0 111.042 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -63.32 -46.09 88.29 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.913 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.537 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.6 mttt -61.25 -39.26 89.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.497 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.8 ttp180 -62.91 -43.62 98.29 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -56.75 -46.13 81.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.167 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.556 HD22 ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -65.65 -33.17 75.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.464 -175.116 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.4 p -70.1 -27.16 64.37 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.51 -0.744 . . . . 0.0 109.986 175.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 85.8 mt -80.91 -46.01 15.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.201 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.556 ' OD1' HD22 ' A' ' 18' ' ' LEU . 1.3 p30 -65.44 -42.27 92.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.21 -0.196 . . . . 0.0 111.302 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.427 ' HA ' HD12 ' A' ' 25' ' ' LEU . 35.1 mt -60.37 -41.5 87.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.016 0.436 . . . . 0.0 110.493 176.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -65.14 -24.12 67.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.585 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.6 mtpp -85.89 -7.63 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.453 ' CD1' HG11 ' A' ' 71' ' ' VAL . 80.4 mt -86.23 137.67 34.78 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.571 -177.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -80.32 167.31 19.56 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.259 2.639 . . . . 0.0 112.841 177.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.01 -46.1 41.72 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 114.39 0.516 . . . . 0.0 114.39 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -53.67 -51.28 63.69 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.451 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.745 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -73.19 -32.73 64.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.642 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.579 HD21 ' CD1' ' B' ' 207' ' ' PHE . 10.6 tp -62.59 -24.63 67.66 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.65 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.87 99.51 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.909 -0.662 . . . . 0.0 111.493 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.545 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.1 tpm_? -67.85 -40.99 83.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.217 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.2 t -59.0 -58.15 8.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.008 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.13 -27.65 42.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.796 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . 0.401 ' HD1' HG22 ' B' ' 214' ' ' THR . 14.2 t60 -68.29 -41.96 80.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.301 -0.409 . . . . 0.0 109.964 176.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.545 HG13 ' HE ' ' A' ' 32' ' ' ARG . 61.8 mt -62.11 -43.47 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 120.974 0.416 . . . . 0.0 110.31 177.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 33' ' ' VAL . 53.2 mt -65.02 -58.5 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.402 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -63.07 -28.47 70.11 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -173.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -89.95 -27.74 19.61 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.489 -0.484 . . . . 0.0 112.123 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -81.89 -22.94 36.59 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.355 171.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -125.0 65.12 46.39 Favored Pre-proline 0 N--CA 1.442 -0.867 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.936 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -52.47 -17.93 7.4 Favored 'Trans proline' 0 N--CA 1.478 0.601 0 C-N-CA 122.971 2.447 . . . . 0.0 113.284 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.4 m -66.3 -21.85 66.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.963 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.59 41.95 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.036 0.446 . . . . 0.0 110.306 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -73.56 -15.55 61.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.154 -174.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -96.52 35.1 1.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.875 0.369 . . . . 0.0 111.213 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.2 m -81.33 89.38 6.08 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 86.3 m-20 -61.35 123.44 76.23 Favored Pre-proline 0 CA--C 1.52 -0.209 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.126 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 71.1 Cg_exo -53.17 -21.74 17.68 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.654 2.903 . . . . 0.0 114.268 -174.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.488 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 4.6 p-10 -76.11 -36.3 58.92 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.875 -177.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -143.7 77.5 1.56 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 26.2 mt -85.84 128.42 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.214 -177.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -101.15 117.87 35.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.41 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 52.8 mt -90.38 108.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.52 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.2 t70 -105.11 99.15 8.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -68.18 -13.37 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.547 -172.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -79.38 -35.26 41.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.789 0.328 . . . . 0.0 110.559 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.4 p -80.91 -21.89 40.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.994 176.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 25.0 mt -67.16 135.62 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.494 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -76.54 147.45 78.64 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.005 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -42.94 -40.46 8.45 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.929 2.42 . . . . 0.0 113.05 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -58.13 -50.22 74.25 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.036 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -47.91 83.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.263 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.82 -37.56 71.37 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.023 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -70.63 -52.11 23.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.174 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -62.99 -39.34 94.44 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 111.059 -177.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.422 HD22 HG11 ' A' ' 33' ' ' VAL . 85.9 mt -60.24 -57.97 10.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.682 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.479 ' O ' HG22 ' A' ' 71' ' ' VAL . 7.9 tt0 -58.77 -45.79 88.99 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.726 0.298 . . . . 0.0 111.155 -178.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -57.67 -30.15 65.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.259 0.552 . . . . 0.0 110.295 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.425 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 65.1 t80 -82.88 -49.2 9.91 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.919 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 68' ' ' GLU . 16.0 m -60.81 -36.18 69.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.239 0.543 . . . . 0.0 110.482 -176.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 22.3 p -69.95 -39.91 75.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 92.4 p -65.63 -20.07 66.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.795 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.745 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.5 t -90.76 -53.49 4.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.762 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.443 ' HG ' HD22 ' A' ' 25' ' ' LEU . 71.1 mt -77.28 -36.0 54.66 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -172.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.505 ' HB2' ' O ' ' A' ' 72' ' ' THR . 98.3 mtt180 -75.33 -7.62 54.46 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.249 0.547 . . . . 0.0 110.472 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -105.85 -47.1 3.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.166 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -134.28 87.52 2.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.518 -173.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -75.1 133.94 41.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 59.53 71.71 0.88 Allowed Pre-proline 0 N--CA 1.464 0.264 0 O-C-N 123.617 0.573 . . . . 0.0 110.174 -171.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -75.39 41.45 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.234 2.623 . . . . 0.0 113.033 -177.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.92 -33.57 68.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.192 0.52 . . . . 0.0 110.141 178.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.597 -0.716 . . . . 0.0 109.692 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 54.2 t30 . . . . . 0 N--CA 1.48 1.054 0 CA-C-O 120.802 0.334 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 30.1 tp -88.48 -33.73 17.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 110.116 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -65.15 119.35 10.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.522 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 21.4 m -101.23 172.85 6.75 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.027 -175.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 29.4 t -83.94 89.03 7.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.976 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.457 HD12 ' HA ' ' A' ' 55' ' ' ASP . 39.3 mm -85.74 121.55 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.093 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.41 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 58.2 t -85.27 117.73 30.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.328 -174.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -105.63 77.95 1.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.605 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.579 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.0 p90 -92.01 158.16 16.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.217 0.532 . . . . 0.0 110.478 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 12.4 mptt -106.73 135.26 48.58 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.624 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -121.03 81.24 35.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.244 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.95 -15.66 20.76 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.533 2.155 . . . . 0.0 111.914 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 94.1 mt -121.93 101.68 41.85 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.475 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -78.82 56.47 5.99 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.487 2.125 . . . . 0.0 112.658 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -98.24 169.41 9.6 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' THR . . . . . 0.401 HG22 ' HD1' ' A' ' 35' ' ' HIS . 3.8 p -147.0 171.78 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.854 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -147.03 111.27 4.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.232 0.539 . . . . 0.0 110.647 177.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -89.15 45.28 0.83 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.176 2.584 . . . . 0.0 111.926 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.454 -1.192 . . . . 0.0 111.649 -178.06 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.796 0.332 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -98.84 -4.99 31.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.674 0.274 . . . . 0.0 111.466 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -63.39 -43.02 98.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.166 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -59.15 -27.23 65.44 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.432 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -83.74 -29.42 27.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.222 0.534 . . . . 0.0 110.441 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -76.31 -28.63 57.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.808 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.7 m -90.86 99.09 12.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.392 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -75.75 144.78 77.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.34 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.51 135.93 51.97 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.847 2.365 . . . . 0.0 111.534 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.426 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -72.66 131.29 42.22 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.826 -175.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 p -76.06 176.71 7.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.782 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.33 -47.88 84.12 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.597 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -53.09 -47.61 68.42 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.399 0.618 . . . . 0.0 110.024 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -63.86 -45.03 91.29 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.963 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.426 ' HE3' ' O ' ' A' ' 10' ' ' MET . 96.2 mttt -59.2 -44.6 92.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.396 175.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.453 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 50.0 ttp85 -59.48 -47.62 84.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.163 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -58.85 -51.94 67.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.968 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.68 -49.82 67.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.827 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.41 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 93.5 p -62.57 -30.81 71.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.918 0.389 . . . . 0.0 111.076 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 94.0 mt -73.55 -41.98 62.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.798 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 23.0 m-20 -67.26 -41.51 85.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.291 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.437 ' HA ' HD12 ' A' ' 25' ' ' LEU . 95.6 mt -58.1 -41.83 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -66.65 -27.59 67.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.532 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.92 -24.82 43.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.061 0.458 . . . . 0.0 110.451 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 22' ' ' ILE . 93.1 mt -66.67 135.49 94.46 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.398 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.483 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.8 Cg_endo -80.49 170.08 16.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.951 2.434 . . . . 0.0 112.858 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.59 -44.0 46.35 Favored Glycine 0 CA--C 1.519 0.329 0 O-C-N 123.195 0.309 . . . . 0.0 113.327 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.409 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 1.3 mp0 -45.43 -54.09 7.83 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.5 0.667 . . . . 0.0 111.203 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.654 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -82.71 -29.42 29.84 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.91 -175.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.74 -27.64 68.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.443 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.3 -28.85 71.6 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.139 174.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' O ' HG13 ' A' ' 36' ' ' ILE . 14.5 tpp180 -84.31 -43.04 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 122.585 -0.362 . . . . 0.0 110.335 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 37' ' ' ILE . 43.4 t -55.07 -54.16 26.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.4 HG21 HD11 ' A' ' 52' ' ' ILE . 9.2 p -65.49 -29.86 48.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.526 -178.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -66.01 -39.86 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.638 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.5 mt -66.93 -49.97 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.949 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 33' ' ' VAL . 50.0 mt -56.95 -59.73 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.089 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -62.48 -32.46 73.36 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.9 t -80.24 -32.57 38.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -82.58 -25.13 33.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 121.92 -0.488 . . . . 0.0 110.21 175.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.454 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.8 mm-40 -117.58 82.08 15.31 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.523 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.11 -15.11 45.91 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.584 2.189 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.9 t -78.31 -24.26 46.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 109.761 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.55 17.94 5.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.199 0.523 . . . . 0.0 110.22 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HZ1' ' HB3' ' A' ' 45' ' ' LYS . 8.1 ttpm? -74.0 -10.73 59.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.476 0.655 . . . . 0.0 109.683 178.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -84.22 4.93 28.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.257 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.0 m -67.48 97.84 0.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.299 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -60.34 122.81 69.93 Favored Pre-proline 0 N--CA 1.452 -0.354 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_exo -52.09 -26.03 24.6 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.664 2.909 . . . . 0.0 113.451 -174.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -71.01 -29.68 65.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.186 -177.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -143.65 76.07 1.5 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.944 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.4 HD11 HG21 ' A' ' 34' ' ' VAL . 22.7 mt -88.4 126.91 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -178.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -108.1 132.55 53.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.775 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.0 mt -104.02 108.84 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 174.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -110.87 97.27 6.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.923 0.868 . . . . 0.0 110.601 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -68.12 -9.27 45.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.937 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.413 ' HG3' HD23 ' B' ' 200' ' ' LEU . 36.6 mm-40 -79.95 -21.4 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.472 -177.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.5 p -99.02 -25.24 14.62 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.454 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 23.3 mt -57.9 130.42 46.45 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.388 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -74.32 148.18 85.89 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.93 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -48.1 -33.93 22.31 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.75 2.3 . . . . 0.0 112.398 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.6 m -57.82 -53.32 59.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.46 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -62.33 -48.45 79.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.739 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.24 -36.68 71.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -69.44 -50.24 47.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.816 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.35 -38.94 91.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.529 ' O ' HG13 ' A' ' 71' ' ' VAL . 85.1 mt -61.22 -56.03 25.26 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.342 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -55.14 -49.77 70.96 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.802 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -55.68 -38.34 69.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.674 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -75.85 -50.08 16.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.726 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.529 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -62.82 -35.79 72.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 -175.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.519 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.7 p -74.61 -38.46 62.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.663 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.6 p -64.99 -19.43 65.99 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.559 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.654 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.4 t -91.02 -55.02 3.71 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.74 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.418 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.1 mt -74.28 -34.5 63.57 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -174.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.519 ' HB2' ' O ' ' A' ' 72' ' ' THR . 28.2 mtp180 -80.07 8.77 6.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.276 0.56 . . . . 0.0 110.226 177.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -114.79 -49.89 2.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.856 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -142.92 86.62 1.94 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.201 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -72.08 -18.16 61.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.976 0.417 . . . . 0.0 111.312 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -129.5 87.58 52.64 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.71 -152.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.082 2.522 . . . . 0.0 112.09 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -68.55 -22.1 64.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.025 0.44 . . . . 0.0 110.757 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . 0.418 ' HB1' ' HB3' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.538 -0.744 . . . . 0.0 110.336 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.667 0.27 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . 0.413 HD23 ' HG3' ' A' ' 57' ' ' GLU . 2.4 pt? -151.9 150.62 30.26 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.773 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -96.59 68.97 2.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.089 0.471 . . . . 0.0 110.484 -177.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 4.6 m -64.0 -45.67 87.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.255 0.55 . . . . 0.0 109.528 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 31.8 t -173.37 -55.09 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.784 -1.098 . . . . 0.0 108.331 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.92 77.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.284 174.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 39.6 t -82.36 133.93 28.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.842 -175.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -116.65 119.9 36.97 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -129.86 137.88 50.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.155 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -89.5 115.02 26.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.952 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . 0.469 ' NZ ' ' HB3' ' B' ' 209' ' ' LYS . 1.5 ttpm? -133.9 69.76 75.11 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.468 ' O ' ' HD3' ' B' ' 212' ' ' PRO . 37.9 Cg_exo -60.1 -24.09 75.62 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.081 2.521 . . . . 0.0 112.41 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . 0.414 HD23 ' OG1' ' B' ' 214' ' ' THR . 58.3 tp -104.57 101.66 29.41 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.235 177.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' B' ' 210' ' ' PRO . 16.7 Cg_exo -68.55 -52.51 0.43 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.745 2.296 . . . . 0.0 111.106 175.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.74 142.57 12.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.946 175.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' THR . . . . . 0.414 ' OG1' HD23 ' B' ' 211' ' ' LEU . 9.4 m -87.45 92.35 9.05 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -130.65 81.72 66.79 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.853 0.359 . . . . 0.0 111.12 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -79.02 -12.85 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.211 1.941 . . . . 0.0 110.793 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 119.039 -0.867 . . . . 0.0 110.977 178.903 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 120.753 0.311 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -66.06 -33.39 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.458 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -62.58 -35.97 81.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.919 0.39 . . . . 0.0 110.413 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.05 -44.97 52.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.137 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -79.02 -34.85 43.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.62 0.247 . . . . 0.0 111.629 -175.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -88.5 -34.68 17.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.62 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.3 m 64.55 100.29 0.04 OUTLIER 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -72.36 144.32 86.64 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.046 173.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -66.36 124.23 12.22 Favored 'Trans proline' 0 C--O 1.236 0.383 0 C-N-CA 122.801 2.334 . . . . 0.0 111.667 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -58.75 125.76 24.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.904 -176.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 p -72.49 175.22 6.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.15 -49.24 78.63 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.874 0.306 . . . . 0.0 110.356 -175.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -55.12 -41.74 72.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.08 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.85 -46.02 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.938 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.67 -42.89 89.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.416 176.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -63.95 -43.5 95.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.298 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -58.85 -43.06 90.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.369 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.681 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -65.64 -38.4 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.275 -177.44 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.8 p -64.55 -28.13 69.43 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 119.979 -0.689 . . . . 0.0 110.093 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.59 -41.21 19.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.459 -178.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.681 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -67.47 -40.87 85.32 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.682 177.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' HD12 ' A' ' 25' ' ' LEU . 79.7 mt -58.78 -40.07 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.093 0.473 . . . . 0.0 110.197 175.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -69.87 -29.4 66.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.824 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.2 mttp -64.13 -34.18 77.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.247 0.546 . . . . 0.0 110.966 173.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.53 ' CD1' HG11 ' A' ' 71' ' ' VAL . 95.4 mt -69.26 131.0 90.61 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.214 -172.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -77.54 172.9 15.04 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 123.525 2.817 . . . . 0.0 112.431 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.33 -45.94 52.38 Favored Glycine 0 CA--C 1.518 0.266 0 O-C-N 123.324 0.39 . . . . 0.0 113.846 -172.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 9.0 mp0 -47.26 -52.47 15.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.643 0.735 . . . . 0.0 111.034 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.578 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 2.1 mptp? -78.36 -23.8 46.72 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.155 -173.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -62.11 -27.37 68.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.124 177.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.29 -35.99 92.41 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.067 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.454 ' O ' HG13 ' A' ' 36' ' ' ILE . 15.5 tpp180 -78.92 -40.83 31.08 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.199 -0.201 . . . . 0.0 110.698 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.468 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.5 t -57.3 -53.62 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.59 -30.71 51.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.963 0.411 . . . . 0.0 110.357 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -65.89 -40.98 92.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.962 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 32' ' ' ARG . 64.8 mt -65.85 -50.89 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.975 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.8 mt -58.56 -58.59 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 -178.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -61.01 -32.53 72.12 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.7 t -79.62 -38.68 33.29 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -176.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -75.6 -27.83 58.67 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.074 176.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.44 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.6 mm-40 -115.78 84.16 12.53 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.122 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.82 -12.83 36.08 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.363 2.042 . . . . 0.0 111.966 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.4 m -79.76 -8.62 59.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.375 177.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.6 mt -113.1 26.96 10.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.09 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -69.69 -23.39 63.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.403 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.69 21.43 1.53 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.024 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.0 m -75.1 91.08 2.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.83 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -53.0 125.86 41.63 Favored Pre-proline 0 CA--C 1.52 -0.211 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.998 173.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.27 -15.18 17.74 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.836 2.357 . . . . 0.0 112.159 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.512 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 16.7 m-20 -85.2 -29.79 24.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.555 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -139.6 59.68 1.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.697 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 18.9 mt -69.64 125.0 26.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.083 0.468 . . . . 0.0 111.508 -175.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -104.93 126.33 51.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.616 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 60.2 mt -107.28 108.3 24.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 173.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.5 p-10 -110.53 103.6 12.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.83 0.824 . . . . 0.0 110.762 176.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -69.68 -12.28 61.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.556 -174.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -74.56 -27.68 60.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.458 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.1 p -95.54 -28.03 15.07 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.097 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.6 mt -56.62 127.1 29.7 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 177.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -71.46 146.95 92.27 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -43.5 -32.85 3.92 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.864 2.376 . . . . 0.0 113.004 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.46 -54.72 43.87 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.686 0.279 . . . . 0.0 110.645 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -60.88 -47.73 85.03 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.234 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.3 mt -55.74 -39.87 71.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.92 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.3 tpt180 -70.47 -49.25 50.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.244 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -63.8 -36.56 84.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.775 0.321 . . . . 0.0 110.632 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.464 ' O ' HG13 ' A' ' 71' ' ' VAL . 84.8 mt -60.82 -56.46 20.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.998 174.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -54.48 -43.03 71.4 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.99 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -60.16 -39.29 85.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.375 0.607 . . . . 0.0 110.35 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -75.85 -47.07 27.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.775 -176.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.53 HG11 ' CD1' ' A' ' 25' ' ' LEU . 11.7 m -64.08 -42.71 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.07 0.462 . . . . 0.0 110.641 -175.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 25.3 p -67.69 -32.29 72.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.491 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.7 t -66.15 -25.32 66.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.263 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.578 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.7 t -91.72 -45.37 8.47 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.977 0.418 . . . . 0.0 110.414 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 21' ' ' ASP . 26.7 mt -85.51 -28.5 24.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -169.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 72' ' ' THR . 30.7 mtp180 -80.43 8.8 6.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.476 0.655 . . . . 0.0 110.116 177.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -120.65 -50.34 2.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.077 170.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 75' ' ' LEU . 75.3 mmtt -132.63 109.74 9.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.197 177.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -87.3 -11.91 48.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.517 0.199 . . . . 0.0 111.38 -176.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -136.78 68.77 58.87 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.852 0.358 . . . . 0.0 110.782 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -79.46 49.29 3.12 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.084 2.523 . . . . 0.0 111.982 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -156.08 157.21 35.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.229 -178.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.84 -0.6 . . . . 0.0 109.953 178.187 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 86.5 mt 51.87 46.91 25.8 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.55 0.531 . . . . 0.0 111.133 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -160.34 100.45 1.35 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.586 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 30.6 p -138.87 -63.33 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.925 174.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 9.0 t -172.76 132.02 0.55 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.279 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 58.3 mt -122.88 104.79 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.14 0.495 . . . . 0.0 110.097 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 47.3 t -92.91 108.03 19.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.62 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 4.4 ttmp? -104.28 109.8 21.77 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.135 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -126.84 151.1 48.8 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.044 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.608 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 67.6 mttm -96.75 130.74 43.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 177.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -101.34 95.17 4.68 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.822 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.608 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 5.2 Cg_exo -77.84 71.22 6.67 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 123.19 2.593 . . . . 0.0 112.433 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.87 116.61 43.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 176.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.06 45.37 1.79 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 122.927 2.418 . . . . 0.0 112.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 34.0 tp -122.86 44.91 2.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 110.285 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 28.3 m -72.42 -36.92 68.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.331 0.586 . . . . 0.0 109.911 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -135.79 102.56 10.27 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.94 178.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -47.73 127.27 13.91 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.094 2.529 . . . . 0.0 112.439 -178.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.951 -0.916 . . . . 0.0 111.661 -177.673 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.79 -22.81 25.67 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.339 -177.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.29 -44.48 94.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.127 0.489 . . . . 0.0 110.138 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -68.7 -21.15 64.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.344 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -79.52 -36.43 38.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.32 0.581 . . . . 0.0 109.994 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -69.77 -51.02 37.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.119 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.6 m -79.36 100.48 7.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.202 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -68.27 144.17 96.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.26 149.72 88.23 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.843 2.362 . . . . 0.0 112.075 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -85.95 119.89 26.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 p -67.6 174.64 3.35 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -46.95 84.29 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.762 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -51.26 -48.7 62.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.682 0.753 . . . . 0.0 109.943 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -65.15 -46.06 82.47 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.062 -175.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.03 -38.98 73.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.268 176.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -62.76 -44.37 96.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.327 175.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -59.74 -43.47 94.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.502 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.768 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -66.42 -38.06 86.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.305 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.7 p -65.37 -26.8 68.17 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.628 -0.67 . . . . 0.0 110.359 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.86 -43.87 19.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.396 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.768 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -64.09 -43.8 94.26 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.775 178.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.9 mt -59.21 -41.96 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.931 0.396 . . . . 0.0 110.724 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -70.25 -27.44 64.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -74.5 -33.97 62.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.491 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.506 HD13 HG11 ' A' ' 71' ' ' VAL . 77.9 mt -56.94 138.19 79.13 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.333 -175.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.604 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 59.0 Cg_endo -79.22 163.24 25.22 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 123.521 2.814 . . . . 0.0 111.583 178.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.31 -27.15 60.13 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.151 -0.931 . . . . 0.0 114.855 -169.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' OE2' ' HB2' ' A' ' 26' ' ' PRO . 1.4 mp0 -63.07 -54.47 37.46 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.594 0.697 . . . . 0.0 109.711 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.604 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 3.8 mptt -72.22 -26.7 62.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.902 -176.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.02 -25.7 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.014 176.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.26 -33.57 86.46 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.944 174.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.437 ' O ' HG13 ' A' ' 36' ' ' ILE . 9.0 tpp180 -79.96 -41.99 24.86 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 122.752 -0.264 . . . . 0.0 110.37 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -56.36 -52.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.472 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.83 -31.24 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.477 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -66.18 -42.14 89.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.998 176.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.1 mt -65.93 -51.4 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.6 mt -57.72 -59.31 3.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.779 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.409 ' OE1' ' HA ' ' A' ' 45' ' ' LYS . 9.9 mt-30 -61.93 -33.74 74.81 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -76.56 -36.28 57.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.592 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -78.47 -31.24 47.79 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.075 0.464 . . . . 0.0 110.024 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.48 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 16.5 mm-40 -116.33 83.26 12.8 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.105 -177.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.89 -15.13 48.84 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.389 2.059 . . . . 0.0 112.456 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -74.52 -19.75 60.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.987 0.422 . . . . 0.0 110.199 177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -95.5 19.01 11.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.409 ' HA ' ' OE1' ' A' ' 38' ' ' GLN . 55.1 tttm -69.98 -9.12 54.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.275 0.56 . . . . 0.0 110.598 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -87.14 11.0 15.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.916 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.5 m -72.81 91.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -62.96 121.76 70.73 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 174.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.99 -34.89 17.47 Favored 'Trans proline' 0 N--CA 1.477 0.526 0 C-N-CA 124.202 3.268 . . . . 0.0 114.977 -170.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.75 -22.44 61.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 111.526 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -140.55 70.65 1.36 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.05 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.4 mt -86.33 121.21 37.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.846 0.355 . . . . 0.0 110.772 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -104.51 126.55 51.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.615 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.8 mt -103.66 109.79 28.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 120.655 0.264 . . . . 0.0 110.551 176.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -107.15 99.13 8.7 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.157 0.98 . . . . 0.0 110.626 175.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -68.14 -4.32 13.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.739 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -80.01 -22.66 42.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.602 0.239 . . . . 0.0 110.823 -178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -101.17 -24.42 14.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.782 0.325 . . . . 0.0 110.153 176.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.48 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 37.4 mt -59.46 125.2 22.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.071 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.32 149.6 91.56 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.051 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -42.7 -36.43 4.94 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.722 2.281 . . . . 0.0 113.452 174.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 m -56.92 -55.02 39.92 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.411 0.148 . . . . 0.0 111.215 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -59.84 -46.11 90.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.208 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.96 -37.32 76.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -73.77 -44.81 54.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.5 -39.83 92.34 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.848 0.356 . . . . 0.0 110.435 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 71' ' ' VAL . 90.8 mt -60.67 -55.79 29.05 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.27 175.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -55.77 -45.9 78.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.341 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.06 -39.09 77.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -77.44 -47.16 20.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.038 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.506 HG11 HD13 ' A' ' 25' ' ' LEU . 16.6 m -62.72 -36.56 75.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.078 0.466 . . . . 0.0 110.735 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.0 p -72.22 -30.71 65.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.701 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -71.79 -19.97 61.93 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.862 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.498 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 47.6 t -90.95 -51.86 5.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.766 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.466 ' HG ' HD22 ' A' ' 25' ' ' LEU . 65.5 mt -79.21 -37.96 36.89 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 72' ' ' THR . 31.5 mtp180 -79.51 -5.53 55.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.75 -177.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -107.57 -30.91 8.34 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.931 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -140.07 110.81 6.8 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.707 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -74.55 -25.22 59.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.192 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.87 110.47 9.34 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.689 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -47.72 126.26 12.38 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 123.394 2.729 . . . . 0.0 113.384 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -106.85 164.08 12.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.244 177.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.448 -0.787 . . . . 0.0 109.855 178.762 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.831 -0.063 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 37.0 tp 55.72 55.11 7.46 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.645 0.736 . . . . 0.0 110.056 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -130.78 85.16 2.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.454 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 10.6 m -70.84 -48.05 56.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 15.8 t -177.48 91.95 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.954 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 68.6 mt -86.44 110.83 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 44.2 t -92.74 103.34 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.138 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.7 ttmm -93.91 100.83 12.92 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.423 ' CE1' ' HB2' ' B' ' 209' ' ' LYS . 32.1 p90 -105.47 124.1 48.99 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.561 175.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -80.18 94.05 5.96 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.705 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . 0.423 ' HB2' ' CE1' ' B' ' 207' ' ' PHE . 56.9 tttm -87.34 129.72 50.36 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.289 -174.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -82.33 171.26 12.62 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.587 2.191 . . . . 0.0 111.566 173.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 95.1 mt -128.72 84.73 62.25 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.939 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -59.77 122.43 11.43 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.486 2.124 . . . . 0.0 111.308 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 91.1 mt -83.07 25.24 0.71 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.097 0.475 . . . . 0.0 111.315 -176.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.1 p -79.78 68.32 5.82 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.862 174.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 61.75 66.32 1.54 Allowed Pre-proline 0 C--O 1.234 0.237 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.76 -174.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -74.18 130.31 14.05 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.584 2.189 . . . . 0.0 112.162 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.285 -1.286 . . . . 0.0 111.201 179.777 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.707 0.289 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -57.91 -40.07 79.45 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -65.36 -54.93 21.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.624 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.19 -23.15 57.64 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.083 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.7 -36.97 83.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.34 0.591 . . . . 0.0 109.786 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.21 -26.38 62.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.072 177.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 61.3 m -87.54 98.47 11.42 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.922 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -73.49 141.67 80.23 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.45 123.66 14.29 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 123.115 2.543 . . . . 0.0 112.016 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.4 mmt -57.63 132.41 53.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.145 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 p -77.75 174.77 10.61 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.47 -45.96 84.21 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 109.919 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -56.41 -44.86 80.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.816 -179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.69 -47.09 79.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.432 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -57.79 -40.4 79.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.277 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 40.5 ttp-105 -59.97 -45.43 92.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.238 175.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -61.78 -41.43 97.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.383 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.718 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.11 -41.16 82.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.925 -178.234 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.424 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 98.5 p -63.15 -25.16 68.22 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.526 -0.734 . . . . 0.0 110.592 175.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.455 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.9 mt -82.24 -45.28 15.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.633 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.718 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -61.78 -42.25 98.75 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.82 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.479 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.4 mt -59.65 -40.69 82.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.067 0.461 . . . . 0.0 110.656 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -71.33 -20.11 62.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.307 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.7 mtpp -85.15 -14.86 45.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.13 0.491 . . . . 0.0 110.437 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' CD1' HG11 ' A' ' 71' ' ' VAL . 92.7 mt -80.03 139.69 53.34 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.189 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.503 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 98.6 Cg_endo -80.61 171.84 14.12 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 123.206 2.604 . . . . 0.0 112.983 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.68 -38.68 64.54 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.622 -0.323 . . . . 0.0 113.33 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 11.1 mp0 -50.53 -56.39 11.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.603 0.716 . . . . 0.0 110.929 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.603 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.3 mptp? -78.24 -27.91 47.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.595 -175.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.08 -31.06 64.85 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.745 175.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.39 -40.91 96.68 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.655 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.415 ' HG2' ' CE1' ' A' ' 70' ' ' TYR . 5.0 tpp180 -73.74 -40.99 63.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.428 0.156 . . . . 0.0 110.8 178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.7 t -56.58 -55.05 21.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.876 0.37 . . . . 0.0 110.65 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.421 HG21 HD11 ' A' ' 52' ' ' ILE . 7.1 p -65.71 -27.85 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -65.27 -43.64 90.62 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.844 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.25 -42.77 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.145 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.1 mt -62.64 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.767 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -63.66 -32.43 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -173.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -72.58 -38.63 67.84 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.812 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.99 -30.8 56.1 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.93 0.395 . . . . 0.0 110.539 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.4 ' CD ' ' HZ2' ' A' ' 60' ' ' LYS . 31.3 mm-40 -117.9 82.07 16.53 Favored Pre-proline 0 N--CA 1.445 -0.685 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.034 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.5 -8.72 23.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.587 2.191 . . . . 0.0 112.838 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -87.48 -5.08 58.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.136 0.493 . . . . 0.0 110.439 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -105.11 25.56 10.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.148 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -76.72 -10.72 59.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.439 0.638 . . . . 0.0 109.684 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -78.99 0.5 27.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.767 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.2 m -69.78 99.37 1.35 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.253 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 p30 -57.06 124.35 65.09 Favored Pre-proline 0 CA--C 1.517 -0.295 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 173.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.6 Cg_exo -57.63 -11.69 9.64 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.935 2.424 . . . . 0.0 112.172 177.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -84.05 -36.07 23.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.634 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -136.44 65.31 1.52 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.775 0.322 . . . . 0.0 111.536 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.421 HD11 HG21 ' A' ' 34' ' ' VAL . 18.1 mt -76.49 124.52 34.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.117 0.484 . . . . 0.0 111.438 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -108.82 110.73 22.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.837 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 53.8 mt -82.27 110.42 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.77 0.319 . . . . 0.0 110.383 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.653 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.0 t70 -103.95 99.0 8.76 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -71.97 -8.12 52.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.169 -176.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -84.22 -34.0 23.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.868 0.366 . . . . 0.0 110.792 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 56.6 p -78.15 -31.89 49.99 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.839 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 32.5 mt -58.91 128.48 37.44 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.904 -176.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.4 ' HZ2' ' CD ' ' A' ' 41' ' ' GLU . 13.8 mtmm -72.36 150.97 91.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.871 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.15 -36.75 29.57 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.363 2.042 . . . . 0.0 112.518 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -59.26 -47.27 85.97 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.488 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -63.76 -47.67 80.07 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.173 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 71.6 mt -59.35 -35.26 73.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.086 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.9 tpt180 -72.1 -46.22 57.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.083 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -66.48 -39.71 88.91 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.962 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.471 ' O ' HG13 ' A' ' 71' ' ' VAL . 89.7 mt -56.96 -57.06 14.18 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.699 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.06 -42.48 76.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.244 177.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 54.1 ttp85 -64.49 -33.45 75.92 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.162 0.506 . . . . 0.0 110.57 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.415 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 71.5 t80 -80.72 -47.17 14.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.782 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.485 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.0 m -62.54 -37.97 80.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.104 0.478 . . . . 0.0 110.637 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.8 p -70.28 -36.7 74.55 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.849 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -62.66 -28.01 69.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.393 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.603 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 44.4 t -89.55 -54.24 4.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.595 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.485 ' HG ' HD22 ' A' ' 25' ' ' LEU . 75.9 mt -76.1 -35.88 59.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -171.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 72' ' ' THR . 54.4 mtp180 -75.73 -5.43 45.66 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.043 -177.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -113.89 -39.42 3.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.741 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -145.31 86.37 1.76 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.125 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -82.67 -5.08 58.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.234 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -109.2 92.98 12.12 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.792 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -48.81 128.17 18.22 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.18 2.587 . . . . 0.0 113.177 -177.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -85.48 49.43 1.76 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.38 0.61 . . . . 0.0 110.533 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.889 179.039 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.966 0.412 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 25.4 tp -123.38 128.76 50.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -81.08 58.81 3.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.081 0.467 . . . . 0.0 110.851 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 45.9 t -65.37 -70.77 0.22 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.065 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 5.8 t -150.96 72.84 1.08 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.68 97.31 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.922 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.424 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 66.6 t -77.73 134.45 28.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.467 -174.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -111.23 131.76 54.87 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.58 144.63 30.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.129 0.49 . . . . 0.0 110.538 173.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.454 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 56.8 mttm -97.37 120.54 37.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.398 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -100.2 103.88 25.87 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.665 0.269 . . . . 0.0 110.864 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 93.7 Cg_endo -86.14 84.86 1.08 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.726 2.284 . . . . 0.0 111.749 179.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 42.0 tp -85.89 115.14 60.58 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.513 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -65.66 110.14 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.625 2.217 . . . . 0.0 111.885 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 96.7 mt -132.7 26.0 4.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.377 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' THR . . . . . 0.425 ' O ' ' HD3' ' B' ' 216' ' ' PRO . 4.8 m 57.07 51.63 10.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.706 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -109.23 93.79 14.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.374 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' B' ' 214' ' ' THR . 90.2 Cg_endo -90.35 -173.61 0.67 Allowed 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.78 2.32 . . . . 0.0 112.028 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.193 -1.337 . . . . 0.0 111.535 177.749 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.513 0.197 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -92.88 -24.93 18.3 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.243 -0.286 . . . . 0.0 111.689 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -59.83 -30.83 69.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 0.0 111.089 -174.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.39 -35.29 79.91 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.038 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -87.54 -40.88 13.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.4 0.619 . . . . 0.0 110.227 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -60.76 -38.16 84.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.506 -178.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.547 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 74.8 m -91.75 99.27 12.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.961 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -71.32 144.95 90.08 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.986 0.422 . . . . 0.0 110.637 176.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -61.41 124.83 15.47 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.809 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.501 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -56.64 134.82 54.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.176 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 m -95.68 176.51 6.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -51.55 -54.5 26.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -166.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -48.93 -49.8 38.44 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.264 0.554 . . . . 0.0 110.691 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.94 -46.1 90.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.455 -174.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.501 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.8 mttt -58.01 -42.14 84.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.444 177.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -62.26 -44.76 95.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.334 177.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -63.93 -38.07 89.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.373 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.648 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.62 -39.19 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.756 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.6 p -64.26 -26.24 68.41 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.515 -0.74 . . . . 0.0 110.357 175.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.45 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 70.8 mt -81.68 -44.72 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.583 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.648 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.2 p30 -62.85 -41.7 99.47 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.676 178.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.525 ' HA ' HD12 ' A' ' 25' ' ' LEU . 94.2 mt -60.26 -41.0 85.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.003 0.43 . . . . 0.0 110.679 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -71.16 -24.18 62.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.245 -177.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 29.1 mtpp -80.31 -22.0 41.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 22' ' ' ILE . 92.1 mt -70.27 139.0 86.94 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.489 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 74.4 Cg_endo -75.15 161.89 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.975 2.45 . . . . 0.0 111.463 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.93 -22.86 58.37 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.337 -0.847 . . . . 0.0 114.003 -170.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -64.42 -52.08 59.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.338 0.589 . . . . 0.0 110.218 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.531 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 2.6 mptp? -69.31 -23.76 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.842 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.61 -27.52 69.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.65 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.86 -33.76 84.58 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.881 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.436 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.9 tpp180 -81.07 -40.84 23.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.447 0.165 . . . . 0.0 110.812 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.478 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.4 t -58.03 -52.05 63.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.918 0.39 . . . . 0.0 110.774 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.96 -30.16 49.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -177.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.53 -41.99 92.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.756 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 32' ' ' ARG . 71.2 mt -64.79 -41.75 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.103 178.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 33' ' ' VAL . 60.9 mt -64.19 -61.5 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.353 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.528 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 28.5 mt-30 -63.17 -30.32 71.49 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -76.48 -36.79 57.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -80.3 -28.2 38.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.662 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.482 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 58.5 mm-40 -111.43 81.35 3.04 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.075 176.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.07 -15.07 47.2 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.395 2.063 . . . . 0.0 112.718 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -84.9 -3.79 58.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.146 0.498 . . . . 0.0 110.494 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.59 23.72 14.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.79 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -64.4 -26.23 68.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.206 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -95.61 41.51 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.342 -178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.528 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 68.7 m -80.24 107.16 12.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.461 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 2.9 p30 -55.84 122.78 48.73 Favored Pre-proline 0 C--O 1.228 -0.066 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.63 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -61.18 -9.03 11.39 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.127 2.551 . . . . 0.0 112.648 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.484 ' CG ' ' HG2' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -82.98 -44.36 15.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.928 179.36 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HG2' ' CG ' ' A' ' 50' ' ' ASP . 5.5 mm-40 -133.57 70.53 1.46 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.481 -177.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.4 mt -74.35 116.14 16.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 CA-C-O 121.319 0.58 . . . . 0.0 110.253 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.541 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.0 mm-40 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.59 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.439 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 47.7 mt -89.63 107.8 18.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 175.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -107.95 98.74 8.27 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.224 1.011 . . . . 0.0 110.76 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -66.78 -7.95 24.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.849 -176.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.94 -20.31 49.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -177.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.6 p -104.5 -29.58 10.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.445 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.461 HD22 HG23 ' A' ' 37' ' ' ILE . 36.2 mt -51.28 123.93 10.65 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.365 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.482 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 57.4 mttp -67.01 152.56 95.88 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.271 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.65 -40.81 30.93 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.444 2.096 . . . . 0.0 112.998 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 21.9 t -54.64 -50.96 66.87 Favored 'General case' 0 C--N 1.334 -0.107 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -51.05 71.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.43 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.47 -39.74 73.71 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.168 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.547 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 22.7 tpt180 -72.51 -46.75 53.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.344 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.2 mt-10 -68.22 -39.37 82.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.754 0.311 . . . . 0.0 110.718 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.435 HD22 HG11 ' A' ' 33' ' ' VAL . 86.9 mt -56.88 -55.25 36.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.593 173.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -56.04 -40.27 73.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.138 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -62.24 -43.71 98.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.441 0.639 . . . . 0.0 110.041 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -74.52 -43.89 53.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.716 -174.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.51 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.0 m -65.16 -37.63 80.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.993 0.425 . . . . 0.0 110.71 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 36.7 p -74.43 -35.71 63.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.327 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.7 p -67.27 -19.93 65.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.428 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.499 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 18.1 t -91.28 -54.84 3.75 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.626 178.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.45 ' HG ' HD22 ' A' ' 25' ' ' LEU . 72.3 mt -78.26 -33.86 49.38 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -171.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 72' ' ' THR . 67.5 mtp180 -81.32 0.09 38.68 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.713 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -114.12 -23.63 9.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.704 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -161.79 106.02 1.24 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.145 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -75.75 -16.01 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.96 0.41 . . . . 0.0 110.763 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -120.12 75.95 22.86 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 172.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -64.72 115.53 3.28 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.948 2.432 . . . . 0.0 112.835 -172.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -95.16 -36.87 11.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.791 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.906 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.984 -179.678 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.58 18.0 19.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.762 0.315 . . . . 0.0 111.193 -178.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -83.68 74.35 10.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.808 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 20.2 m -104.01 -58.1 1.93 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 18.2 p -166.22 63.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.876 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 40.6 mt -70.93 121.58 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.607 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 40.8 t -96.89 109.69 23.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.483 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.541 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 20.9 ttmm -95.8 111.05 23.11 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -127.67 144.35 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.613 176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -99.81 122.81 43.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.412 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -113.28 99.82 50.07 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.766 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.403 ' O ' ' HD3' ' B' ' 212' ' ' PRO . 31.6 Cg_exo -59.26 138.85 87.17 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.273 1.982 . . . . 0.0 110.435 172.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 91.3 mt -75.38 115.48 45.75 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-O 120.739 0.304 . . . . 0.0 111.26 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' B' ' 210' ' ' PRO . 83.4 Cg_endo -87.33 152.6 7.95 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.885 2.39 . . . . 0.0 111.344 175.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 8.4 mp -79.66 126.99 31.64 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 11.0 p -77.86 93.45 4.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 61.21 79.48 0.28 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.583 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -79.65 53.74 4.87 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.051 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.366 -177.434 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.527 0.203 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.72 -31.98 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.532 -175.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.512 ' HG2' ' HB2' ' A' ' 62' ' ' SER . 6.9 tp10 -62.17 -37.19 84.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.023 0.44 . . . . 0.0 110.369 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.15 -24.61 67.45 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.647 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -88.21 -23.73 23.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.001 -177.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.59 -49.22 4.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.726 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.8 m -103.8 100.86 10.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.443 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -72.08 147.01 90.64 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -62.77 123.7 12.78 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.874 2.383 . . . . 0.0 112.012 -176.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.523 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -55.37 136.02 49.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.625 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.7 m -91.75 175.21 6.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -51.76 -57.84 8.12 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -164.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -56.44 -34.12 66.53 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -177.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.36 -45.96 71.41 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.3 mttt -60.07 -42.12 93.87 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.846 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 16' ' ' ARG . 18.4 ttp85 -62.68 -43.5 98.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.483 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -67.23 -42.08 84.63 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.821 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.34 -50.03 74.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.264 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.402 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.1 p -59.77 -33.77 72.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.211 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.2 mt -71.59 -42.22 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.757 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.428 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 67.7 m-20 -62.61 -44.31 96.61 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.548 0.214 . . . . 0.0 111.165 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.472 ' HA ' HD12 ' A' ' 25' ' ' LEU . 96.8 mt -61.22 -34.31 60.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 0.0 111.35 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.98 -24.51 32.89 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.043 0.925 . . . . 0.0 108.747 -174.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HD3' HD22 ' A' ' 75' ' ' LEU . 19.8 ttmt -73.06 -32.33 64.97 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.786 173.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 22' ' ' ILE . 90.0 mt -62.6 142.12 96.77 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 121.153 0.502 . . . . 0.0 111.843 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.459 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.5 Cg_endo -82.38 169.56 13.94 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 123.045 2.497 . . . . 0.0 112.874 176.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.6 -46.0 53.83 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 114.482 0.553 . . . . 0.0 114.482 -172.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -47.27 -56.83 6.02 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.823 0.82 . . . . 0.0 110.989 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.609 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -74.4 -24.88 59.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.814 -174.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.9 mt -65.13 -27.41 68.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.266 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.24 -34.38 89.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.967 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.465 ' O ' HG13 ' A' ' 36' ' ' ILE . 19.4 tpp180 -77.7 -39.65 44.0 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.504 ' O ' HG13 ' A' ' 37' ' ' ILE . 87.0 t -57.64 -55.24 22.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.024 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 p -63.51 -30.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.898 0.38 . . . . 0.0 110.615 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -63.86 -42.12 97.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.749 176.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.3 mt -66.0 -44.83 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -61.67 -60.55 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.165 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.36 -35.92 74.78 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -79.24 -33.85 43.26 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.98 -26.81 36.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.503 176.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.451 ' HG3' HD23 ' A' ' 59' ' ' LEU . 61.3 mm-40 -115.72 85.33 13.96 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.762 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -63.51 -13.2 34.91 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.23 1.954 . . . . 0.0 112.424 178.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.7 m -79.85 -10.04 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.001 0.429 . . . . 0.0 110.565 176.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -108.81 29.01 7.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.119 0.485 . . . . 0.0 110.21 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -69.12 -23.75 64.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.335 -175.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -95.55 25.02 4.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.503 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 p -73.25 101.03 3.27 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.398 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -56.06 122.48 48.07 Favored Pre-proline 0 C--O 1.227 -0.131 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.452 178.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -58.25 -14.37 19.56 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.936 2.424 . . . . 0.0 112.039 176.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.07 -37.44 29.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.699 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -136.92 59.97 1.67 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.645 0.259 . . . . 0.0 111.442 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 19.7 mt -70.16 124.02 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.026 0.441 . . . . 0.0 111.496 -175.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.41 ' CD ' ' HB2' ' B' ' 206' ' ' LYS . 44.8 mm-40 -109.84 115.25 29.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.629 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 34.5 mt -90.11 109.97 21.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 177.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 16.0 p-10 -105.98 99.01 8.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.83 0.824 . . . . 0.0 110.659 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -69.94 -0.26 7.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.699 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.533 ' HG3' ' C ' ' B' ' 200' ' ' LEU . 5.0 mm-40 -87.88 -22.58 24.33 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.219 -175.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 75.4 p -102.18 -32.9 9.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.834 176.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.5 mt -48.3 123.03 5.9 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.025 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -65.26 152.04 92.68 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.792 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -48.76 -35.04 29.43 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.435 2.09 . . . . 0.0 112.321 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.512 ' HB2' ' HG2' ' A' ' 3' ' ' GLU . 3.8 t -56.37 -53.04 62.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 176.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -46.54 88.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.718 -178.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.9 mt -59.14 -36.18 74.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -76.83 -45.31 29.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.076 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -62.29 -45.51 92.92 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.527 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.569 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.4 mt -57.37 -55.41 35.18 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.109 176.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -55.45 -47.99 75.19 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.17 -40.57 81.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.883 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -74.29 -47.57 33.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.641 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.569 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.8 m -65.26 -35.34 75.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.81 0.338 . . . . 0.0 110.312 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.461 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 35.6 p -72.88 -39.69 66.21 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.647 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 91.8 p -63.9 -21.77 66.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.729 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.609 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.2 t -90.77 -48.22 7.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.798 0.332 . . . . 0.0 110.316 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.43 ' HG ' HD22 ' A' ' 25' ' ' LEU . 70.6 mt -82.37 -37.09 26.14 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -171.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.461 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 82.6 mtp180 -77.08 -7.41 55.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.076 0.465 . . . . 0.0 110.377 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -102.51 -43.85 5.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.507 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -137.51 102.51 4.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.987 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -63.56 -26.62 68.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.765 0.317 . . . . 0.0 111.259 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -128.15 89.5 49.93 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -67.16 66.68 0.63 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.367 2.711 . . . . 0.0 113.408 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -86.53 -41.94 13.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.729 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.13 -0.938 . . . . 0.0 111.233 178.713 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . 0.533 ' C ' ' HG3' ' A' ' 57' ' ' GLU . 57.2 tp -160.98 -49.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.455 0.169 . . . . 0.0 111.048 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -143.11 50.41 1.42 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.547 0.213 . . . . 0.0 111.268 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 46.9 t -60.31 -51.94 67.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.582 176.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 13.6 p -157.59 128.49 6.57 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp -120.83 127.18 75.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.0 110.933 177.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.402 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.3 t -114.92 104.09 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.359 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.612 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.1 ttmm -90.12 109.59 20.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 171.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -124.65 137.84 54.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.411 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 26.4 mtpp -88.76 122.45 32.18 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -97.77 106.67 35.26 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -178.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 15.5 Cg_exo -68.53 108.94 1.94 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.835 2.356 . . . . 0.0 112.372 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.78 -48.07 80.2 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.387 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -79.46 67.86 8.47 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.706 1.604 . . . . 0.0 111.506 173.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.75 -33.27 72.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.095 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 17.9 p -116.57 91.69 3.66 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.064 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . 0.405 ' HB3' ' HD3' ' B' ' 216' ' ' PRO . 10.0 tt0 -63.23 -50.81 73.29 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.619 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . 0.405 ' HD3' ' HB3' ' B' ' 215' ' ' GLN . 97.0 Cg_endo -78.39 34.86 0.51 Allowed 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 122.046 1.831 . . . . 0.0 112.273 176.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.969 0 CA-C-O 119.098 -0.834 . . . . 0.0 111.278 -177.659 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 120.646 0.26 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -67.58 -34.15 76.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -173.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -65.04 -44.95 87.39 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.895 0.379 . . . . 0.0 110.513 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -72.17 -40.45 67.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.29 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.49 -56.82 5.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 -177.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -72.6 -38.27 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.776 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m 66.24 99.58 0.05 OUTLIER 'General case' 0 C--O 1.234 0.283 0 O-C-N 123.519 0.512 . . . . 0.0 111.528 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -65.8 147.18 98.88 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.341 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -72.07 140.55 34.71 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.594 2.196 . . . . 0.0 111.252 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.49 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.63 120.2 23.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.297 -177.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.9 p -69.92 179.45 2.26 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.51 -50.81 72.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 121.273 -0.171 . . . . 0.0 110.981 -173.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -56.8 -41.76 78.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.834 0.35 . . . . 0.0 111.073 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.29 -44.96 93.53 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.731 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.49 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.9 mttt -62.7 -41.04 98.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.688 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttp85 -64.36 -43.15 95.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 110.107 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.24 -41.73 97.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.739 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.764 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.99 -32.6 72.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.103 -176.04 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.6 p -68.38 -26.76 65.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.624 -0.673 . . . . 0.0 109.925 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.7 mt -83.8 -39.18 20.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.691 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.764 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.5 p30 -66.17 -41.1 90.78 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.896 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.8 mt -60.94 -40.31 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 0.0 110.096 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -66.67 -29.07 68.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 48.6 mttp -66.25 -28.65 68.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.107 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.515 ' CD1' HG11 ' A' ' 71' ' ' VAL . 94.5 mt -76.39 135.84 68.83 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.385 -171.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.437 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 86.7 Cg_endo -81.72 171.94 12.73 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.265 2.643 . . . . 0.0 112.531 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.83 -45.11 61.32 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 114.333 0.493 . . . . 0.0 114.333 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -46.66 -52.69 13.22 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.532 0.682 . . . . 0.0 111.478 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.505 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -80.47 -29.24 37.44 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.057 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' B' ' 207' ' ' PHE . 12.9 tp -63.19 -24.28 67.81 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.825 0.345 . . . . 0.0 110.2 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.76 -37.02 94.14 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 111.807 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.479 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.7 tpp180 -75.47 -39.02 59.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.411 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.0 t -57.33 -55.01 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.076 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.49 -30.81 51.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.022 0.439 . . . . 0.0 110.482 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -64.29 -41.54 96.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.153 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 32' ' ' ARG . 67.7 mt -63.76 -47.35 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.396 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 33' ' ' VAL . 46.5 mt -63.95 -59.56 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.341 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.58 -31.29 70.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 t -77.99 -39.53 42.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.891 -0.324 . . . . 0.0 111.401 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.06 -28.58 57.68 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.073 0.463 . . . . 0.0 110.447 176.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -116.9 78.98 9.76 Favored Pre-proline 0 N--CA 1.44 -0.929 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.468 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.27 -15.66 49.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.18 1.92 . . . . 0.0 112.391 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.3 t -73.08 -12.72 61.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.133 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.09 23.31 14.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -65.29 -31.6 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.725 0.297 . . . . 0.0 111.262 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -85.65 41.95 0.93 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.255 0.55 . . . . 0.0 110.735 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.0 m -84.5 99.99 11.07 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -52.81 117.01 10.05 Favored Pre-proline 0 CA--C 1.523 -0.093 0 O-C-N 123.75 0.656 . . . . 0.0 110.233 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.97 -31.74 45.0 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.701 2.934 . . . . 0.0 114.222 -172.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -73.87 -27.74 61.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.2 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -141.49 79.18 1.67 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.152 0.501 . . . . 0.0 109.652 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 50.5 mt -89.84 126.55 42.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.891 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.5 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 33.9 mm-40 -98.78 123.34 42.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.917 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.435 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.4 mt -98.01 108.59 22.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 170.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -108.92 100.8 9.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.141 0.972 . . . . 0.0 110.587 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -70.58 -2.85 15.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.546 -1.206 . . . . 0.0 112.128 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -83.0 -23.29 33.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.0 p -97.98 -26.67 14.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.958 0.409 . . . . 0.0 110.095 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.2 mt -58.75 127.53 32.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.047 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -69.76 147.8 96.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -44.19 -34.82 7.29 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.54 2.16 . . . . 0.0 113.095 173.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.6 m -56.69 -51.71 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.145 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -63.37 -45.65 90.14 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.261 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.7 mt -59.07 -35.09 72.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.717 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -71.54 -51.54 22.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.121 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -57.49 -42.86 83.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.543 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.489 ' O ' HG13 ' A' ' 71' ' ' VAL . 78.8 mt -58.69 -58.96 6.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.6 177.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.428 ' O ' HG22 ' A' ' 71' ' ' VAL . 29.0 tt0 -57.21 -45.42 83.84 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.765 0.317 . . . . 0.0 111.297 -178.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -58.54 -38.63 78.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.27 0.557 . . . . 0.0 110.612 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -75.59 -47.89 24.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.653 -177.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 25' ' ' LEU . 11.5 m -62.9 -39.85 86.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.069 0.461 . . . . 0.0 110.396 -176.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.537 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.6 p -68.67 -30.81 69.58 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.105 -178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 85.6 p -68.96 -23.19 64.11 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.377 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.505 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 45.6 t -92.43 -44.95 8.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.121 0.486 . . . . 0.0 110.542 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 21' ' ' ASP . 27.9 mt -83.41 -33.76 25.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.574 -171.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.3 mtp180 -78.31 -1.56 33.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.249 0.547 . . . . 0.0 110.05 176.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -104.97 -34.32 8.05 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.253 172.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -150.6 104.29 3.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.104 176.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.2 ptt180 -66.47 111.13 3.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.265 176.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? 60.72 79.07 0.29 Allowed Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.335 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -70.34 99.82 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.928 2.419 . . . . 0.0 112.47 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -101.66 97.74 8.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.876 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.822 -177.076 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 96.0 mt -135.19 60.13 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . 0.401 ' HB3' HD11 ' B' ' 204' ' ' ILE . 76.6 mt-30 -138.69 72.69 1.41 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.328 -174.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 11.6 t -75.59 -38.35 59.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.015 0.436 . . . . 0.0 109.853 177.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 9.2 p -165.03 130.71 2.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.149 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . 0.435 ' N ' HD13 ' B' ' 204' ' ' ILE . 4.3 mp -125.35 120.53 58.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.199 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.435 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 60.4 t -104.05 109.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.136 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.5 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.1 ttmm -99.75 81.9 2.53 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.55 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.5 p90 -93.35 159.19 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.003 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 25.2 ttmm -110.13 119.95 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.59 107.96 33.79 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 23.4 Cg_exo -64.47 118.97 5.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.74 2.294 . . . . 0.0 111.769 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 61.1 tp -108.73 106.29 58.5 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.637 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.64 56.86 2.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.807 2.338 . . . . 0.0 111.915 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.5 tp -147.97 -57.19 0.23 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.5 p -76.8 -46.7 23.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.627 172.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -120.59 87.45 41.58 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.66 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -48.7 -39.38 38.16 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.395 2.73 . . . . 0.0 113.289 -179.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.788 0 CA-C-O 119.095 -0.836 . . . . 0.0 111.364 178.494 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.3 t . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.949 0.404 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.97 -29.37 70.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.856 -174.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -69.73 -45.97 66.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.462 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -67.79 -26.95 66.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.248 0.547 . . . . 0.0 110.982 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -80.81 -31.64 35.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.051 0.453 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -69.55 -37.67 77.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.72 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.592 ' SG ' ' HB2' ' A' ' 65' ' ' ARG . 52.8 t -151.54 137.27 17.96 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.526 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -85.23 145.31 42.54 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.027 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -64.23 127.45 19.24 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.85 2.367 . . . . 0.0 111.69 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -61.27 128.86 38.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.226 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.6 p -75.0 176.73 6.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -48.23 80.76 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -53.31 -46.84 69.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.364 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.27 -45.23 77.26 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.864 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.425 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.9 mttt -56.46 -38.56 71.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.18 175.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -60.93 -45.31 95.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.314 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -62.95 -39.94 96.15 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.591 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.613 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -69.07 -30.64 69.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.202 -178.269 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.512 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 80.9 p -69.71 -30.03 67.56 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.431 -0.793 . . . . 0.0 110.011 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.6 mt -80.25 -39.18 29.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.608 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.613 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.3 p30 -68.0 -42.48 80.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.397 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -59.5 -39.36 79.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.558 177.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -67.16 -30.86 70.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.902 0.382 . . . . 0.0 111.138 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -62.54 -30.04 71.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.842 175.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.532 ' CD1' HG11 ' A' ' 71' ' ' VAL . 95.9 mt -73.36 139.28 78.44 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.381 -172.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.03 170.28 15.34 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.127 2.552 . . . . 0.0 112.866 177.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.79 -46.26 48.49 Favored Glycine 0 C--N 1.333 0.39 0 O-C-N 123.368 0.418 . . . . 0.0 113.649 -174.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.6 mp0 -47.03 -56.87 5.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.265 0.555 . . . . 0.0 110.988 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -27.09 61.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.52 -176.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.2 -25.16 67.64 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.773 0.32 . . . . 0.0 110.547 178.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.38 92.74 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.073 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 32' ' ' ARG . 5.4 tpp180 -76.8 -40.19 48.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.666 0.27 . . . . 0.0 110.537 177.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.433 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.0 t -57.75 -54.07 36.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.897 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.31 -29.84 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.573 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.87 -45.29 90.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.644 176.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.9 mt -63.7 -47.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.845 -179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.6 mt -62.63 -58.99 5.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.768 -178.369 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -62.74 -30.98 71.84 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.3 t -70.39 -50.73 35.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.602 0.239 . . . . 0.0 110.895 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -69.29 -30.85 69.02 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.94 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' CD ' ' HZ1' ' A' ' 60' ' ' LYS . 15.9 mm-40 -116.97 81.29 12.14 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.649 -178.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.03 -18.38 64.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.4 2.066 . . . . 0.0 113.104 -177.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.7 t -70.42 -27.79 64.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.036 0.446 . . . . 0.0 110.114 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.38 23.27 1.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.833 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -72.03 -13.0 61.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.365 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -85.14 4.8 32.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.286 0.565 . . . . 0.0 110.621 -177.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.4 m -66.86 104.7 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.159 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 123.66 71.89 Favored Pre-proline 0 CA--C 1.52 -0.2 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 173.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.75 -14.28 17.12 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.001 2.468 . . . . 0.0 112.409 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.04 -33.64 22.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.928 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -137.29 68.02 1.42 Allowed 'General case' 0 C--O 1.227 -0.112 0 CA-C-O 120.713 0.292 . . . . 0.0 110.758 -178.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.9 mt -78.42 122.09 32.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.346 -175.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -102.34 122.13 43.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.558 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.0 mt -93.63 109.0 21.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -105.42 95.51 5.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.14 0.972 . . . . 0.0 110.627 176.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -66.47 -5.27 10.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.28 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -82.23 -27.97 32.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.634 0.254 . . . . 0.0 110.944 -177.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.3 p -93.05 -22.48 19.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 27.1 mt -59.9 131.8 51.99 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.078 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.406 ' HZ1' ' CD ' ' A' ' 41' ' ' GLU . 11.8 mtmm -82.79 153.84 67.66 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.119 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.2 -43.94 24.83 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.446 2.097 . . . . 0.0 113.057 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 70.6 m -52.23 -52.0 54.96 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.147 0.279 . . . . 0.0 111.153 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -60.75 -45.68 93.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 64.0 mt -60.9 -36.83 80.27 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.01 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.592 ' HB2' ' SG ' ' A' ' 7' ' ' CYS . 32.1 tpt180 -70.75 -50.33 37.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 177.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 62' ' ' SER . 60.0 mm-40 -59.05 -41.05 86.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.905 0.383 . . . . 0.0 110.225 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.4 HD22 HG11 ' A' ' 33' ' ' VAL . 80.1 mt -61.91 -58.16 9.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.692 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.429 ' O ' HG22 ' A' ' 71' ' ' VAL . 23.4 tt0 -54.48 -45.23 73.16 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.056 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.86 -36.23 80.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.924 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -75.78 -49.11 19.06 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.549 -178.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.532 HG11 ' CD1' ' A' ' 25' ' ' LEU . 13.7 m -62.65 -40.36 88.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.122 0.486 . . . . 0.0 110.537 -175.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 29.1 p -65.63 -35.14 79.92 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.082 -177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.9 p -66.0 -24.77 66.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 110.624 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 44.0 t -91.33 -41.99 10.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.743 0.306 . . . . 0.0 110.579 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 21' ' ' ASP . 29.8 mt -89.7 -38.36 13.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -168.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -73.28 -4.71 34.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.853 0.835 . . . . 0.0 109.227 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -99.93 -47.14 5.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.132 170.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.6 tptt -154.06 108.07 3.0 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.895 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -64.56 -25.12 67.84 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.193 0.52 . . . . 0.0 110.817 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -138.31 89.25 14.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.492 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -52.62 123.08 12.06 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.363 2.709 . . . . 0.0 112.705 -176.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -158.63 99.87 1.59 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.874 -179.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.53 -0.747 . . . . 0.0 110.086 179.058 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.961 0.41 . . . . 0.0 110.875 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 92.2 mt -77.45 93.84 4.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.872 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -152.84 123.45 7.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 0.0 111.099 -175.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 4.2 p -89.61 -41.89 11.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.028 175.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 33.5 t -165.39 99.27 0.71 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.877 176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp -87.69 105.16 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.794 0.807 . . . . 0.0 111.401 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.512 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 57.7 t -87.8 113.47 25.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.103 -176.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 19.7 ttmm -96.51 113.77 25.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.73 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -125.38 139.73 53.41 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.351 0.596 . . . . 0.0 110.6 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.508 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 62.7 mttm -89.81 122.51 32.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.316 -0.856 . . . . 0.0 108.696 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -97.71 102.39 13.08 Favored Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.508 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 52.6 Cg_exo -53.85 106.35 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.332 2.688 . . . . 0.0 112.662 -174.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.9 -51.26 72.53 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -77.29 68.79 7.37 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.0 1.8 . . . . 0.0 112.468 177.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 52.7 tp -78.67 88.6 4.56 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 17.0 m -74.39 -39.05 62.93 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.011 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -130.67 108.63 15.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.435 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.21 60.28 6.25 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.905 2.404 . . . . 0.0 112.096 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.405 -1.219 . . . . 0.0 111.653 179.017 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.947 0.403 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -84.23 -26.61 28.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.077 -178.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.35 -44.89 76.37 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.541 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.52 -20.39 64.59 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.559 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 36.5 t70 -85.02 -19.11 32.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.097 0.475 . . . . 0.0 110.602 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -105.45 -35.1 7.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.097 0.475 . . . . 0.0 110.202 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.478 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 55.7 m -104.94 97.69 7.51 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.339 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.559 ' HE3' ' O ' ' A' ' 5' ' ' ASP . 1.4 mptm? -87.4 143.91 34.98 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.785 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.08 123.31 12.64 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.795 2.33 . . . . 0.0 111.433 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.431 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.4 mmt -62.81 130.12 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.634 -176.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.0 m -90.14 177.68 6.37 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -57.64 -54.11 50.58 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -165.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -48.99 -41.26 33.76 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.41 -48.39 70.2 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.694 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 10' ' ' MET . 95.0 mttt -57.58 -40.73 79.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.279 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -63.78 -47.07 82.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.335 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -60.33 -46.11 91.05 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.19 -48.21 82.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.471 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.572 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.7 p -60.81 -32.99 72.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.144 0.497 . . . . 0.0 110.753 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -76.68 -34.93 58.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.547 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.501 ' O ' HD13 ' A' ' 75' ' ' LEU . 64.0 m-20 -68.91 -41.93 77.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.228 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.16 -35.22 60.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.948 0.404 . . . . 0.0 110.664 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.95 -24.88 59.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.764 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.44 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.6 mttp -66.33 -42.84 87.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.295 0.569 . . . . 0.0 110.363 172.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.484 HD13 HG11 ' A' ' 71' ' ' VAL . 96.1 mt -58.41 136.04 85.45 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.651 -174.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.529 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.1 Cg_endo -80.3 172.43 13.7 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.381 2.72 . . . . 0.0 112.88 177.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.46 -46.3 52.86 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 123.328 0.393 . . . . 0.0 114.034 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -48.71 -58.21 5.11 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.208 0.528 . . . . 0.0 111.843 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.529 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.3 mptp? -71.22 -23.91 62.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.964 -175.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -63.63 -26.72 68.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.336 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.63 89.87 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.026 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.404 ' O ' HG13 ' A' ' 36' ' ' ILE . 22.6 tpp180 -78.76 -41.0 31.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.538 0.209 . . . . 0.0 110.578 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.448 ' O ' HG13 ' A' ' 37' ' ' ILE . 95.6 t -55.97 -55.53 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.004 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.97 -31.8 53.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.604 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -64.95 -41.09 95.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.884 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.7 mt -64.95 -44.93 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.177 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -62.25 -61.64 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.972 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -61.78 -31.83 72.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -173.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -79.81 -30.93 40.65 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.698 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -83.96 -25.32 30.16 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.227 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.06 81.68 16.6 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.508 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.89 -16.18 53.33 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.694 2.263 . . . . 0.0 113.116 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 m -78.48 -8.4 58.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.013 0.435 . . . . 0.0 110.317 176.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.6 mt -110.07 28.81 8.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.228 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -81.81 -8.33 59.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.469 0.652 . . . . 0.0 110.514 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -103.4 30.46 4.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.708 176.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.0 m -72.48 110.88 7.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.578 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.79 118.6 13.73 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 123.204 0.315 . . . . 0.0 110.202 175.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.99 -13.03 32.61 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.705 2.27 . . . . 0.0 111.109 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.653 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 4.3 m-20 -78.29 -37.46 44.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.16 -178.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.11 60.94 1.36 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.502 0.191 . . . . 0.0 110.993 -176.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 16.2 mt -63.21 123.48 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.039 0.447 . . . . 0.0 111.898 -173.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' B' ' 206' ' ' LYS . 41.0 mm-40 -100.7 116.96 33.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.432 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.419 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.6 mt -95.35 107.25 19.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 174.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -107.48 98.38 8.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.907 0.861 . . . . 0.0 110.273 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -68.59 -6.07 23.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.867 -1.061 . . . . 0.0 112.162 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -76.8 -31.11 56.75 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.77 0.319 . . . . 0.0 110.84 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 p -93.32 -22.82 18.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.43 131.56 50.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.11 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -74.29 152.8 88.11 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.079 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -49.27 -34.88 32.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.599 2.199 . . . . 0.0 111.939 174.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.5 m -56.79 -52.4 65.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.252 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.18 -47.86 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.616 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.02 -35.3 69.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.15 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.478 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 27.9 tpt180 -73.35 -49.97 24.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.779 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -63.63 -41.51 98.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.782 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.543 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.3 mt -58.33 -55.87 29.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.334 176.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -55.81 -47.75 76.62 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.882 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -57.65 -38.15 74.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.097 0.475 . . . . 0.0 110.873 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -75.61 -49.28 18.96 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.589 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.543 HG13 ' O ' ' A' ' 67' ' ' LEU . 6.3 m -63.91 -39.85 86.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.763 0.316 . . . . 0.0 110.27 -175.424 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.6 p -67.04 -35.64 80.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.11 -178.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -67.91 -24.51 65.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.866 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.1 t -91.96 -26.26 18.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.05 0.452 . . . . 0.0 110.814 -178.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 21' ' ' ASP . 31.1 mt -103.45 -44.99 4.98 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -171.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -69.88 -16.09 63.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.63 -13.53 58.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.043 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.419 ' HB3' ' H ' ' A' ' 79' ' ' ARG . 2.3 tppp? -148.31 -94.48 0.08 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.406 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.419 ' H ' ' HB3' ' A' ' 78' ' ' LYS . 38.1 ptt180 171.41 -47.68 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.531 0.733 . . . . 0.0 109.659 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -154.53 95.53 2.68 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.609 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -73.15 110.8 3.13 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.246 1.964 . . . . 0.0 112.006 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -86.12 65.67 9.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.645 0.736 . . . . 0.0 109.342 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.033 -0.984 . . . . 0.0 109.993 -178.611 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 120.718 0.294 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.63 -24.34 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.921 0.391 . . . . 0.0 111.0 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -120.47 97.26 5.48 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.589 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 6.4 p -88.83 -169.68 2.62 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.386 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 37.6 t -71.92 95.59 1.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.789 0.328 . . . . 0.0 110.602 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 32.4 mm -83.23 130.04 36.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.572 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.4 t -109.64 129.74 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.253 -173.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 53' ' ' GLU . 37.6 ttmt -118.25 117.66 29.72 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.2 p90 -133.42 145.08 49.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.252 0.549 . . . . 0.0 111.274 -178.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 55.9 mttp -89.25 128.5 35.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.294 173.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -109.11 107.83 60.1 Favored Pre-proline 0 C--N 1.322 -0.602 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.443 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.37 130.58 27.28 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.671 2.247 . . . . 0.0 111.464 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 80.2 mt 63.42 88.6 0.12 Allowed Pre-proline 0 C--O 1.233 0.187 0 O-C-N 123.751 0.657 . . . . 0.0 110.611 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -59.58 0.44 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.129 2.552 . . . . 0.0 112.291 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 33.1 tp -159.78 52.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 22.8 p -79.81 -68.25 0.69 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.846 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -146.19 124.83 6.44 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 -177.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -77.97 54.31 4.81 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.811 2.34 . . . . 0.0 111.28 173.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -1.28 . . . . 0.0 111.487 -177.431 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 120.581 0.229 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -57.2 -40.22 77.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.779 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -72.97 -37.2 67.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.07 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -76.84 -31.49 56.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.948 0.404 . . . . 0.0 110.612 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.55 -27.37 64.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.531 0.682 . . . . 0.0 109.832 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -74.41 -14.26 60.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.054 177.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 85.3 m -91.77 103.04 15.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.909 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.03 148.34 47.66 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.093 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.18 129.8 28.35 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.0 2.467 . . . . 0.0 112.399 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.444 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -66.31 132.7 48.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.48 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 p -75.44 177.04 6.96 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.3 -47.81 84.45 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.285 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.68 -47.05 70.8 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.345 0.593 . . . . 0.0 109.874 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.26 -46.86 84.88 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.652 -176.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.444 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.2 mttt -58.19 -40.01 80.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.154 176.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -63.25 -42.94 99.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.547 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -64.37 -36.06 82.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.943 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.729 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.42 -31.8 69.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.735 178.818 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.51 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 60.4 p -70.0 -25.32 63.55 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.569 -0.707 . . . . 0.0 110.001 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.3 -39.27 17.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.334 -178.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.729 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -67.61 -41.27 84.27 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.804 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.451 ' HA ' HD12 ' A' ' 25' ' ' LEU . 41.7 mt -60.17 -38.6 77.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.171 0.51 . . . . 0.0 110.15 174.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -68.35 -31.15 70.34 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.753 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -63.39 -38.87 92.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.024 173.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.499 ' CD1' HG11 ' A' ' 71' ' ' VAL . 94.3 mt -64.38 135.17 96.24 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.681 -173.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.512 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -80.36 172.78 13.21 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.533 2.822 . . . . 0.0 113.012 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.8 -46.93 48.18 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.275 0.47 . . . . 0.0 114.275 -172.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.481 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.1 mp0 -48.74 -52.6 22.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.683 0.754 . . . . 0.0 111.335 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.5 mptp? -76.4 -24.36 54.07 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.193 -173.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.87 -29.19 68.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.046 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.04 -43.72 99.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.783 176.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.558 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.6 tpm_? -68.47 -42.11 79.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.686 0.279 . . . . 0.0 110.66 177.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.453 HG11 HD22 ' A' ' 67' ' ' LEU . 88.3 t -58.17 -58.03 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.927 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 p -62.45 -29.53 47.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.514 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -69.63 -41.82 75.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.323 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.558 HG13 ' HE ' ' A' ' 32' ' ' ARG . 64.4 mt -61.69 -41.83 91.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 175.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.441 HG23 HD22 ' A' ' 59' ' ' LEU . 72.7 mt -62.7 -60.45 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.002 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -174.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -72.53 -42.89 64.24 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.988 -178.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.401 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.27 -35.81 71.5 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.557 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.461 ' CD ' ' HZ2' ' A' ' 60' ' ' LYS . 55.6 mm-40 -114.73 86.14 12.53 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.776 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -64.25 -16.26 54.07 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.233 1.956 . . . . 0.0 112.365 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 m -77.36 -12.27 59.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.923 0.392 . . . . 0.0 110.711 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 61.4 mt -99.99 26.44 6.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.123 0.487 . . . . 0.0 110.498 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -70.52 -15.11 62.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.437 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -81.06 11.82 3.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 m -72.57 94.37 1.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.401 176.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.3 119.36 55.56 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -49.84 -31.33 26.08 Favored 'Trans proline' 0 N--CA 1.476 0.452 0 C-N-CA 123.872 3.048 . . . . 0.0 114.651 -174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -74.61 -28.99 61.13 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.134 -0.227 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -140.3 72.95 1.41 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -175.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.532 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 26.8 mt -87.3 126.1 41.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.798 0.332 . . . . 0.0 111.377 -176.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.43 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.8 mm-40 -103.43 116.22 32.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.897 178.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.423 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.0 mt -88.99 108.36 18.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -107.88 100.2 9.59 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 122.135 0.969 . . . . 0.0 110.466 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -67.22 -10.12 47.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.235 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -77.15 -30.21 54.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.098 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.4 p -89.31 -26.58 21.04 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 109.922 177.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.441 HD22 HG23 ' A' ' 37' ' ' ILE . 39.7 mt -59.0 126.97 29.91 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.822 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.461 ' HZ2' ' CD ' ' A' ' 41' ' ' GLU . 20.4 mtmm -68.6 151.11 97.43 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.94 -34.76 17.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.522 2.148 . . . . 0.0 112.436 174.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -55.92 -56.21 23.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.495 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -58.87 -46.29 88.14 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.677 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.5 mt -58.57 -35.76 72.89 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.974 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.465 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 31.0 tpt180 -76.39 -47.39 23.42 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.001 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -60.33 -42.65 96.11 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.771 0.32 . . . . 0.0 110.42 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.453 HD22 HG11 ' A' ' 33' ' ' VAL . 80.2 mt -59.49 -58.27 9.36 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.482 175.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.503 ' O ' HG22 ' A' ' 71' ' ' VAL . 28.4 tt0 -54.38 -47.15 73.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -58.03 -37.45 74.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.206 0.527 . . . . 0.0 110.56 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 62.8 t80 -74.77 -47.53 30.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.764 -179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 68' ' ' GLU . 10.7 m -63.42 -40.96 90.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.002 0.43 . . . . 0.0 110.347 -176.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.493 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.3 p -67.59 -31.0 70.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.331 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.422 ' HB3' ' O ' ' A' ' 70' ' ' TYR . 45.2 t -59.96 -33.66 72.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.397 175.605 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.499 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.5 t -91.56 -36.13 13.87 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.736 0.303 . . . . 0.0 111.025 -175.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 21' ' ' ASP . 21.0 mt -94.17 -29.43 15.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -170.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 72' ' ' THR . 72.2 mtp180 -76.23 -16.42 59.82 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -87.32 -57.6 2.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.133 171.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -129.73 101.07 5.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.893 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -67.73 116.45 8.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.958 0.409 . . . . 0.0 110.624 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 25.8 tptp 56.67 69.65 1.68 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.713 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -57.47 125.8 19.95 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.214 2.609 . . . . 0.0 113.246 -171.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -96.18 168.67 10.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.402 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.301 178.391 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.64 0.257 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.61 75.19 9.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 0.0 110.54 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.79 11.06 2.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.314 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 20.6 p -151.53 176.57 11.2 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.838 0.351 . . . . 0.0 111.02 -176.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 22.1 t -73.02 91.49 1.58 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.459 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 50.4 mt -86.1 112.45 22.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.039 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.51 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 48.7 t -87.69 104.87 14.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.313 -175.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.532 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 3.9 ttmp? -91.73 103.98 16.49 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.473 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -116.65 151.57 36.02 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.383 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -103.62 105.53 15.79 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.174 -178.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . 55.2 tttp -75.35 115.68 47.59 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.325 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' B' ' 209' ' ' LYS . 16.8 Cg_exo -66.36 123.67 11.47 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.568 2.178 . . . . 0.0 111.841 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 80.9 mt -117.81 79.26 13.1 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.16 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.75 133.96 10.61 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.174 1.916 . . . . 0.0 111.756 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.7 tp -89.73 -51.2 5.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.551 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 214' ' ' THR . . . . . 0.462 ' O ' ' HD3' ' B' ' 216' ' ' PRO . 45.9 m 66.95 114.46 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.694 0.621 . . . . 0.0 111.471 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -83.99 108.03 12.59 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.893 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' B' ' 214' ' ' THR . 94.3 Cg_endo -90.4 9.99 3.07 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.824 2.349 . . . . 0.0 113.096 -176.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.901 -0.944 . . . . 0.0 111.914 179.902 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.48 0.181 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -99.1 -26.96 14.04 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 122.112 -0.367 . . . . 0.0 111.412 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -46.33 74.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.85 -173.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.46 ' HA ' ' O ' ' A' ' 7' ' ' CYS . 2.2 pm0 -74.08 -15.58 61.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.779 0.323 . . . . 0.0 111.004 -178.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -77.79 -35.69 51.19 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -83.09 -45.44 13.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.915 177.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.46 ' O ' ' HA ' ' A' ' 4' ' ' GLU . 12.3 m -113.09 97.78 6.73 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -83.95 134.08 44.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 121.728 0.775 . . . . 0.0 112.429 -173.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -53.91 129.55 34.76 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 124.069 3.179 . . . . 0.0 112.197 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.5 mmt -66.24 149.19 50.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.725 -175.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.46 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 19.1 p -86.06 172.74 10.38 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 171.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.28 -46.29 90.35 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 118.704 0.684 . . . . 0.0 109.314 -178.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -53.67 -48.13 69.76 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.177 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.43 -44.89 92.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.95 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 11' ' ' SER . 45.3 mttp -59.58 -38.81 82.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.651 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.3 ttp-105 -60.07 -42.14 93.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.074 0.464 . . . . 0.0 109.947 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -63.79 -39.21 93.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.468 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.805 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.62 -39.59 73.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.549 -178.533 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.442 ' HB2' HG21 ' B' ' 205' ' ' VAL . 85.7 p -61.45 -29.74 70.14 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.531 -0.731 . . . . 0.0 110.233 174.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 58.6 mt -78.58 -43.22 27.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.637 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.805 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.8 p30 -63.12 -41.32 99.3 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.682 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.459 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.9 mt -59.31 -41.05 82.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.68 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.411 HD21 ' HA ' ' A' ' 23' ' ' ASN . 8.1 m120 -72.09 -21.0 61.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.649 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.5 mtpp -84.94 -13.4 50.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.06 0.457 . . . . 0.0 110.248 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 96.1 mt -81.73 136.73 47.88 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.978 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.46 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.0 Cg_endo -79.25 171.92 15.45 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.278 2.652 . . . . 0.0 112.941 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.86 -44.59 61.33 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 121.456 -0.402 . . . . 0.0 113.694 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -48.52 -52.75 21.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 122.857 0.463 . . . . 0.0 110.809 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.582 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -76.46 -28.18 56.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.234 -177.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.417 ' O ' HG11 ' A' ' 34' ' ' VAL . 10.8 mt -60.06 -30.25 69.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.877 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.25 -39.81 96.52 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.822 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.413 ' O ' HG13 ' A' ' 36' ' ' ILE . 24.0 tpp180 -72.61 -42.92 63.97 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 177.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.535 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.9 t -57.11 -54.78 25.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.836 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.417 HG11 ' O ' ' A' ' 30' ' ' LEU . 12.0 p -65.72 -29.03 45.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.803 -178.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.84 -42.96 94.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.413 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.6 mt -64.6 -43.18 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.263 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 33' ' ' VAL . 49.3 mt -63.22 -62.58 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.83 -36.72 79.82 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -68.86 -46.57 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.423 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.38 -35.23 77.39 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.823 0.344 . . . . 0.0 110.663 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.527 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 29.3 mm-40 -114.17 85.04 9.8 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.909 -174.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.35 -13.64 40.87 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.225 1.95 . . . . 0.0 111.789 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -79.2 -5.47 54.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 177.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 51.9 mt -108.91 33.18 4.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.237 0.542 . . . . 0.0 109.739 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -68.19 -17.84 64.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.425 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.44 41.85 1.01 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.203 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.8 m -98.67 88.1 3.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.119 0.485 . . . . 0.0 110.644 178.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 61.7 m-80 -68.87 124.33 90.02 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.802 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -55.43 -21.68 31.09 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.429 2.752 . . . . 0.0 114.275 -174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -72.62 -35.33 67.8 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -144.88 76.56 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.168 -175.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.593 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.0 mt -76.02 127.11 37.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.021 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -100.94 129.11 46.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.63 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 32.9 mt -110.23 108.43 25.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.05 102.65 11.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.046 0.927 . . . . 0.0 110.298 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.9 -13.65 61.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.547 -1.206 . . . . 0.0 112.628 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -77.58 -25.58 50.09 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.238 -177.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.5 p -91.49 -23.98 19.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.437 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 22.9 mt -59.5 130.2 45.71 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.63 176.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.527 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 19.8 mttm -73.24 148.49 88.65 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.541 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.41 -34.1 24.62 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.271 1.981 . . . . 0.0 112.248 174.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.3 t -57.12 -55.16 38.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.245 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -60.32 -47.7 84.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.777 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 mt -60.34 -37.08 79.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.117 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.43 -48.02 65.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.572 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -64.16 -44.65 91.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.423 HD22 HG11 ' A' ' 33' ' ' VAL . 94.1 mt -58.43 -56.08 26.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.352 177.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB2' HD13 ' A' ' 18' ' ' LEU . 37.1 tt0 -55.48 -43.79 75.87 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.087 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -61.0 -41.91 97.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 0.0 111.043 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -71.82 -47.36 53.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.714 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.462 HG11 ' CD1' ' A' ' 25' ' ' LEU . 17.5 m -63.75 -38.72 83.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.158 0.504 . . . . 0.0 110.976 -175.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 34.3 p -73.6 -31.61 63.66 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.472 ' O ' ' HD2' ' A' ' 77' ' ' LYS . 31.5 t -69.92 -19.41 63.39 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.256 177.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.582 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 38.4 t -90.46 -55.71 3.48 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.39 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.466 ' HG ' HD22 ' A' ' 25' ' ' LEU . 76.4 mt -77.68 -36.07 51.61 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 72' ' ' THR . 39.8 mtp180 -82.06 -6.37 59.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.807 -176.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.472 ' HD2' ' O ' ' A' ' 73' ' ' SER . 54.6 mttm -105.87 -20.34 13.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.204 173.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -157.92 99.15 1.67 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.301 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 79' ' ' ARG . 16.0 ptt180 -67.02 -26.37 66.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.64 -173.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -120.69 83.8 36.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.06 0.457 . . . . 0.0 110.125 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -65.64 108.47 1.24 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.834 2.356 . . . . 0.0 112.105 -177.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -92.39 123.45 35.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.287 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.685 -0.674 . . . . 0.0 110.119 177.676 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.81 0.338 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 34.4 tp -150.18 -11.96 0.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.051 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 69.85 -59.03 0.51 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.56 0.744 . . . . 0.0 111.003 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 66.0 p -151.76 149.95 29.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -51.31 115.39 1.56 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.875 0.735 . . . . 0.0 111.85 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 34.0 mt -95.18 116.99 38.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.764 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.442 HG21 ' HB2' ' A' ' 19' ' ' SER . 60.6 t -85.23 137.01 21.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.406 -173.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.593 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.7 mptp? -119.17 132.75 56.0 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -138.89 145.14 39.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.911 0.386 . . . . 0.0 110.236 174.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.439 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 62.8 mttm -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.275 178.251 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -116.18 90.29 28.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.242 -175.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . 0.439 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 2.0 Cg_endo -82.73 39.86 0.89 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 123.301 2.667 . . . . 0.0 112.078 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . 0.416 ' HB2' ' HD3' ' B' ' 212' ' ' PRO . 88.5 mt -90.75 -52.8 0.3 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.925 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . 0.416 ' HD3' ' HB2' ' B' ' 211' ' ' LEU . 73.0 Cg_endo -75.78 -8.1 18.92 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.719 1.612 . . . . 0.0 111.346 173.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 46.0 tp -121.67 98.62 6.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.625 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 10.5 p -84.25 32.81 0.49 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.46 0.647 . . . . 0.0 111.079 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -122.91 94.15 47.65 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.571 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.63 165.77 29.73 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.381 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.972 0 CA-C-O 118.54 -1.144 . . . . 0.0 111.604 178.672 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.865 0.364 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -86.81 -6.34 58.84 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -174.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.8 -53.64 53.11 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -71.7 -13.23 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.677 -177.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.94 -43.08 65.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.478 0.656 . . . . 0.0 109.35 175.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -82.6 -39.97 21.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.046 177.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.4 m -102.03 97.74 8.03 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.358 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -68.95 143.05 94.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.099 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.66 132.39 40.08 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.855 2.37 . . . . 0.0 111.27 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.508 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -65.61 126.52 28.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.267 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 p -72.81 175.13 6.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.505 ' OH ' ' HA ' ' B' ' 202' ' ' SER . 2.0 t80 -59.67 -49.98 75.63 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.655 -174.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -55.59 -41.95 74.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.197 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.57 -45.79 85.51 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.925 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.508 ' HE3' ' O ' ' A' ' 10' ' ' MET . 92.0 mttt -59.94 -42.24 93.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -63.52 -40.29 96.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.376 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -61.33 -41.05 96.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.715 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.87 -33.43 73.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -179.613 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.429 ' HB2' HG22 ' B' ' 205' ' ' VAL . 80.1 p -68.56 -25.97 65.17 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.509 -0.744 . . . . 0.0 110.016 174.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -86.33 -38.15 17.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.416 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.715 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -68.17 -41.15 81.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.667 176.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.59 -37.8 76.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.077 0.465 . . . . 0.0 110.364 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.32 -33.09 73.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.926 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -62.56 -40.06 95.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.333 0.587 . . . . 0.0 110.469 174.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.515 ' CD1' HG11 ' A' ' 71' ' ' VAL . 91.4 mt -63.97 133.12 95.48 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.117 -175.083 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.493 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 85.3 Cg_endo -81.25 171.47 13.8 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.185 2.59 . . . . 0.0 112.951 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.6 -43.58 46.05 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 114.443 0.537 . . . . 0.0 114.443 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.522 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 1.3 mp0 -51.76 -57.19 9.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.625 0.726 . . . . 0.0 110.797 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.583 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -71.68 -25.33 62.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.726 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.7 mt -64.29 -24.05 67.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.009 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.94 -33.79 88.14 Favored Glycine 0 C--N 1.335 0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.103 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -79.17 -38.85 34.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.697 0.284 . . . . 0.0 110.356 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.481 ' O ' HG13 ' A' ' 37' ' ' ILE . 60.3 t -59.29 -53.27 50.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.778 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 p -60.51 -33.45 54.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.993 0.425 . . . . 0.0 110.559 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -65.3 -44.44 87.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.173 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -63.47 -46.27 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.469 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.2 mt -60.33 -65.71 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.892 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.447 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 0.0 OUTLIER -58.35 -33.33 69.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -176.589 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 41.1 t -74.27 -27.72 60.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.729 0.299 . . . . 0.0 111.092 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -89.2 -27.37 20.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.063 0.459 . . . . 0.0 110.472 174.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -119.93 87.05 37.67 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.802 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -66.67 -10.64 28.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.167 1.911 . . . . 0.0 111.869 173.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.2 m -85.84 4.44 37.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.8 mt -117.09 47.57 1.47 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 110.588 177.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -90.75 -4.11 56.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.465 0.65 . . . . 0.0 110.037 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -77.66 -13.75 59.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.188 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.447 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.5 m -77.88 86.79 4.1 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.526 176.593 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -71.24 129.61 88.89 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-N 115.122 -0.944 . . . . 0.0 108.945 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.461 ' HA ' HD13 ' A' ' 52' ' ' ILE . 59.5 Cg_exo -47.58 -25.51 5.46 Favored 'Trans proline' 0 N--CA 1.479 0.675 0 C-N-CA 124.204 3.27 . . . . 0.0 115.083 -174.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -81.69 -23.26 36.95 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.443 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -144.65 77.89 1.55 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.142 0.496 . . . . 0.0 110.173 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.501 HD12 ' CE1' ' B' ' 207' ' ' PHE . 38.9 mt -91.01 129.4 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.437 -175.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.573 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 28.0 mm-40 -103.63 138.53 40.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.468 174.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.477 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.2 mt -112.81 108.89 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -111.94 99.0 7.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.06 0.933 . . . . 0.0 110.292 174.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -66.19 -12.64 57.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.129 -174.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.82 -26.97 60.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.913 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.3 p -93.38 -26.32 17.31 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.416 HD22 HG23 ' A' ' 37' ' ' ILE . 26.7 mt -59.47 132.4 53.87 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.132 178.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mtmm -81.12 149.75 66.9 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.444 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.82 -41.59 11.82 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.956 2.438 . . . . 0.0 112.867 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -53.05 -54.08 40.7 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.716 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.5 m -61.31 -48.11 82.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.832 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.6 mt -58.01 -35.42 71.23 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.14 0.495 . . . . 0.0 110.976 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.64 -46.09 48.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.783 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -64.78 -42.88 94.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.644 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.38 -56.74 17.96 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.568 177.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.416 ' O ' HG22 ' A' ' 71' ' ' VAL . 20.9 tt0 -55.4 -44.27 76.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.37 -37.77 78.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 110.912 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -78.39 -47.32 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.016 -177.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.515 HG11 ' CD1' ' A' ' 25' ' ' LEU . 15.4 m -61.46 -41.82 91.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.139 0.495 . . . . 0.0 110.399 -176.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.409 ' H ' HG22 ' A' ' 71' ' ' VAL . 24.9 p -65.66 -35.72 81.59 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.932 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.9 p -68.49 -23.24 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.853 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.583 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.4 t -91.4 -29.54 17.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.87 0.367 . . . . 0.0 110.704 -179.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 21' ' ' ASP . 34.8 mt -101.64 -37.1 8.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -80.89 -3.21 50.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.264 0.554 . . . . 0.0 110.633 -177.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -104.25 -20.91 13.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.076 170.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -161.22 98.42 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.764 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -60.2 -25.89 65.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.862 0.363 . . . . 0.0 111.726 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -127.58 86.77 57.67 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.57 94.7 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.889 2.393 . . . . 0.0 112.769 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -82.86 -18.2 41.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 109.676 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.91 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.231 175.666 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 . . . . . 0 N--CA 1.484 1.228 0 CA-C-O 120.873 0.368 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -90.32 125.24 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.86 0.362 . . . . 0.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -128.52 91.94 3.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.038 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' SER . . . . . 0.505 ' HA ' ' OH ' ' A' ' 12' ' ' TYR . 19.6 m -88.67 152.67 21.67 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.516 -178.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 34.2 m -72.31 90.92 1.29 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 45.8 mm -78.76 132.88 31.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.903 178.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.477 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 3.5 t -95.69 147.74 5.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.002 -177.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.573 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.8 ttmm -139.09 112.77 8.38 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.501 ' CE1' HD12 ' A' ' 52' ' ' ILE . 30.0 p90 -132.51 136.14 46.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.367 0.603 . . . . 0.0 111.017 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -98.94 90.46 4.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.346 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -67.32 132.31 93.27 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.145 -172.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.71 135.79 62.51 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.592 2.195 . . . . 0.0 111.58 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -70.99 146.34 92.78 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.52 178.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -72.25 74.14 2.57 Favored 'Trans proline' 0 N--CA 1.465 -0.206 0 C-N-CA 122.607 2.205 . . . . 0.0 111.695 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 4.1 pp -82.24 -12.39 58.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.251 -176.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 35.5 m -105.92 85.7 2.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.194 0.521 . . . . 0.0 110.567 177.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -133.63 100.89 13.32 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.017 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.79 116.56 3.19 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.13 2.553 . . . . 0.0 112.396 -178.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.14 0 CA-C-O 118.182 -1.343 . . . . 0.0 111.282 179.44 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.0 m . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -53.28 -53.41 51.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.89 0.376 . . . . 0.0 111.881 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -79.78 -23.35 42.23 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.631 -172.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.442 ' HA ' ' NH2' ' A' ' 65' ' ' ARG . 33.8 tt0 -73.08 -36.97 66.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.261 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -82.05 -45.83 14.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.125 -178.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -67.42 -53.6 27.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.168 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.578 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 77.2 m 64.84 98.82 0.04 OUTLIER 'General case' 0 C--O 1.235 0.311 0 O-C-N 123.496 0.498 . . . . 0.0 111.694 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -68.83 144.43 95.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.212 173.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.4 130.6 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.841 2.361 . . . . 0.0 111.746 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.581 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 25.8 mmt -65.88 135.39 54.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.878 -175.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.412 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 22.9 p -84.14 178.33 7.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.883 175.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.02 -50.02 75.68 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 117.672 0.215 . . . . 0.0 110.646 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -53.95 -41.66 68.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.231 0.539 . . . . 0.0 111.102 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.16 -46.86 69.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.581 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.9 mttt -60.46 -36.99 79.57 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.402 177.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -65.05 -41.82 94.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.683 0.278 . . . . 0.0 110.307 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.97 -42.88 99.16 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.97 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.731 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -67.92 -32.13 72.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.289 -177.832 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.1 p -69.53 -26.86 64.72 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 173.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.515 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 82.8 mt -82.93 -46.14 13.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.057 -178.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.731 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -60.46 -41.86 94.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.848 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.484 ' HA ' HD12 ' A' ' 25' ' ' LEU . 34.8 mt -61.34 -42.02 92.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.815 0.341 . . . . 0.0 110.682 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -70.19 -25.87 63.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 0.0 111.212 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 52.1 mtpt -78.92 -19.62 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.993 0.425 . . . . 0.0 110.59 178.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 93.9 mt -75.0 138.64 72.74 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.238 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.48 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 97.4 Cg_endo -79.93 172.03 14.58 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 123.238 2.625 . . . . 0.0 112.954 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.2 -44.44 57.51 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.381 -0.438 . . . . 0.0 113.427 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -47.8 -54.27 12.89 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.325 0.583 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.652 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -79.87 -31.89 40.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.996 -175.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -61.81 -27.16 68.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.595 176.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.13 -35.91 79.54 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.867 173.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.461 ' O ' HG13 ' A' ' 36' ' ' ILE . 18.8 tpp180 -79.24 -44.31 22.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.478 0.18 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 37' ' ' ILE . 42.8 t -55.16 -52.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.659 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.28 -31.63 53.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.79 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.0 t60 -69.57 -41.13 76.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.96 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.513 HD13 ' HG3' ' A' ' 66' ' ' GLU . 55.6 mt -64.67 -43.0 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.139 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 33' ' ' VAL . 52.3 mt -62.56 -59.25 4.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.476 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.518 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 31.3 mt-30 -61.69 -31.81 71.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -175.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 t -77.02 -47.81 19.64 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.162 -0.336 . . . . 0.0 111.183 -177.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -67.64 -29.99 69.45 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.97 0.414 . . . . 0.0 110.279 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.435 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 33.8 mm-40 -113.32 83.41 6.6 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.096 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -65.52 -15.85 51.38 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.024 1.816 . . . . 0.0 111.287 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.2 m -73.25 -13.87 61.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.55 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 64.0 mt -110.21 27.0 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.097 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -62.1 -32.69 73.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.254 -176.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -88.9 42.88 1.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.153 0.501 . . . . 0.0 110.804 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.518 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.2 m -76.04 92.1 3.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.979 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -52.54 116.99 9.73 Favored Pre-proline 0 CA--C 1.519 -0.223 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.704 177.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -54.85 -30.35 67.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.113 2.542 . . . . 0.0 113.422 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -76.69 -24.15 53.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.143 -178.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -140.28 72.95 1.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.424 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.2 mt -87.81 125.73 41.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.936 0.398 . . . . 0.0 111.198 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -106.4 117.53 34.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.43 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.415 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 59.4 mt -93.83 109.12 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 173.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -110.64 100.66 9.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.937 0.875 . . . . 0.0 110.629 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -66.98 -6.89 18.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.505 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -81.71 -27.89 33.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.718 0.294 . . . . 0.0 111.209 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.4 -24.38 18.09 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.435 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 36.9 mt -61.04 123.27 17.15 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.618 176.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.8 mptt -69.92 148.21 96.22 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.653 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -44.75 -33.59 7.29 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.507 2.138 . . . . 0.0 113.257 175.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.2 t -60.84 -46.7 89.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.496 0.189 . . . . 0.0 110.726 178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.426 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.5 m -65.38 -48.11 74.02 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.76 -37.85 74.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.832 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.578 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 8.7 tpt180 -71.5 -49.48 40.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.828 178.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.513 ' HG3' HD13 ' A' ' 36' ' ' ILE . 6.8 tp10 -56.28 -48.43 76.63 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.175 0.512 . . . . 0.0 110.164 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 71' ' ' VAL . 96.1 mt -57.14 -58.24 9.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.312 178.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.442 ' O ' HG22 ' A' ' 71' ' ' VAL . 28.8 tt0 -55.04 -47.85 74.23 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.947 0.403 . . . . 0.0 111.004 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -58.04 -36.34 72.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.63 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -80.06 -46.07 17.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.835 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.465 HG11 ' CD1' ' A' ' 25' ' ' LEU . 17.0 m -64.1 -39.41 85.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.14 0.495 . . . . 0.0 110.636 -175.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.589 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 23.9 p -72.14 -34.0 68.2 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.532 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.5 p -67.98 -17.71 64.52 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.204 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.652 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.7 t -91.41 -54.26 3.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.663 177.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.433 ' HG ' HD22 ' A' ' 25' ' ' LEU . 65.7 mt -77.03 -30.34 55.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -173.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.589 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.8 mtp180 -82.09 -5.12 58.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.148 0.499 . . . . 0.0 110.297 177.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -99.46 -42.89 6.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.367 174.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.483 ' HE3' ' HB2' ' A' ' 82' ' ' GLN . 26.7 tptp -141.69 97.42 3.15 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.334 176.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.5 ptt180 -72.35 123.1 22.32 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.6 tttt 70.67 111.98 0.03 OUTLIER Pre-proline 0 CA--C 1.532 0.285 0 O-C-N 123.873 0.733 . . . . 0.0 110.356 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.15 136.76 68.85 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.754 2.303 . . . . 0.0 112.545 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.483 ' HB2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 tp60 -88.93 110.22 20.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.412 179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.759 -0.638 . . . . 0.0 110.329 179.139 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 120.46 0.171 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 89.1 mt 54.23 38.96 30.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.369 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 57.9 tp60 -98.53 121.12 40.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.993 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 10.9 p -65.01 -71.65 0.18 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.192 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 75.7 m -146.37 152.03 38.44 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.409 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 pt -124.83 111.92 29.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.52 178.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . 0.415 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 12.5 t -95.73 117.19 39.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.174 -177.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 26.9 mttm -106.26 89.02 2.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -101.0 137.29 39.56 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.459 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -98.0 116.56 30.47 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.039 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . 0.414 ' HE3' HD11 ' B' ' 211' ' ' LEU . 65.7 tttp -93.18 115.45 65.01 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.071 -174.593 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -86.75 109.85 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.693 2.262 . . . . 0.0 112.011 176.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . 0.414 HD11 ' HE3' ' B' ' 209' ' ' LYS . 2.3 pt? -152.28 158.54 33.54 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.56 -67.99 0.07 OUTLIER 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.937 . . . . 0.0 111.853 176.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -176.61 -72.42 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.7 t -124.34 17.61 9.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.402 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 68.73 101.84 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.298 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.729 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.42 58.13 6.19 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.902 2.402 . . . . 0.0 111.944 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.535 -1.147 . . . . 0.0 111.24 178.803 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.8 m . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.909 0.385 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -60.64 -38.43 84.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -64.13 -35.97 82.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.318 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.61 -40.43 92.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.793 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -76.22 -34.32 59.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.628 178.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -61.83 -37.97 86.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.172 0.51 . . . . 0.0 110.655 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.1 m -80.2 100.38 8.27 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.008 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -69.75 146.67 95.87 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.84 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.01 126.24 19.78 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.865 2.377 . . . . 0.0 112.173 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . 0.406 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 24.6 mmt -57.08 134.77 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.703 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 m -88.67 174.77 7.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.51 -54.92 40.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -165.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -51.65 -40.06 59.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.657 0.265 . . . . 0.0 111.695 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.66 -47.33 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.491 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.406 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.5 mttt -58.52 -41.96 86.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.943 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.421 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 ttp180 -63.48 -46.63 85.29 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.334 177.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.429 HD13 ' HB2' ' A' ' 68' ' ' GLU . 0.5 OUTLIER -60.89 -50.92 71.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.412 178.536 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 95.7 p -58.74 -37.02 75.29 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.975 0.417 . . . . 0.0 110.866 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 98.1 mt -70.3 -40.52 74.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.653 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.532 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 63.7 m-20 -67.25 -37.2 83.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.45 ' HA ' HD12 ' A' ' 25' ' ' LEU . 87.4 mt -62.28 -40.11 86.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.898 0.38 . . . . 0.0 110.719 176.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -72.23 -28.96 63.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.098 0.475 . . . . 0.0 110.563 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.489 ' CB ' HD13 ' A' ' 75' ' ' LEU . 46.6 mttp -62.13 -39.0 91.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.692 171.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 96.0 mt -64.47 141.43 98.21 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.787 -175.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.4 Cg_endo -82.77 172.08 11.41 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.479 2.786 . . . . 0.0 112.717 178.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.11 -39.41 63.57 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.886 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.5 mp0 -48.34 -59.53 3.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.73 0.776 . . . . 0.0 111.171 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -77.42 -29.32 52.92 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.022 -176.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.6 -29.85 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.801 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.8 -35.06 80.45 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.84 175.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -80.69 -38.92 28.09 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 122.749 -0.266 . . . . 0.0 110.748 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.437 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -55.34 -53.76 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 110.548 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.411 HG21 HD11 ' A' ' 52' ' ' ILE . 13.5 p -63.78 -30.92 51.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.672 -179.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -66.59 -41.26 88.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.101 177.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . 0.472 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 66.0 mt -63.08 -43.17 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.048 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.4 mt -64.39 -62.29 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.937 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -60.67 -35.43 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.2 t -74.02 -36.81 64.47 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.264 -176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.472 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 11.0 mpt_? -77.73 -31.84 52.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.271 176.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.424 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 21.0 mm-40 -117.91 86.37 25.04 Favored Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.473 -176.128 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.26 -9.72 24.79 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.299 1.999 . . . . 0.0 112.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.4 m -84.47 -3.87 58.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 110.393 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.8 mt -114.29 29.29 8.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.522 0.677 . . . . 0.0 109.325 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -82.19 -9.96 59.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 -172.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -100.6 24.12 9.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.379 0.609 . . . . 0.0 110.355 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.6 p -77.87 103.35 7.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.337 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -57.61 119.72 35.28 Favored Pre-proline 0 CA--C 1.52 -0.192 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.804 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.408 ' HA ' HD13 ' A' ' 52' ' ' ILE . 86.4 Cg_exo -51.59 -25.31 19.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 123.546 2.83 . . . . 0.0 113.832 -176.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.592 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 18.5 m-20 -77.67 -28.33 51.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.433 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -143.03 76.64 1.54 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.411 HD11 HG21 ' A' ' 34' ' ' VAL . 41.9 mt -87.97 129.51 39.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.069 -176.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.519 ' HG2' ' HZ3' ' B' ' 206' ' ' LYS . 2.2 mp0 -108.44 123.93 49.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.214 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.419 HD11 HG22 ' A' ' 54' ' ' ILE . 17.9 mt -95.74 108.67 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 175.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.439 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 13.0 p-10 -104.06 97.65 7.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.008 0.908 . . . . 0.0 110.852 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -71.57 -0.42 10.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.983 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -84.93 -22.13 29.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.84 0.352 . . . . 0.0 110.582 -178.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.7 p -102.52 -25.02 13.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.978 0.418 . . . . 0.0 110.078 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 37.7 mt -57.06 131.83 51.08 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.784 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.408 ' HZ1' ' CD ' ' A' ' 41' ' ' GLU . 18.2 mtmm -75.89 150.55 83.79 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.32 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -45.8 -41.63 19.82 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 113.31 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.8 p -57.72 -48.11 80.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -62.82 -47.51 83.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.157 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.0 mt -57.96 -40.59 80.93 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.987 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -68.36 -46.52 69.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.271 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -68.13 -39.71 82.67 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.065 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.608 ' O ' HG13 ' A' ' 71' ' ' VAL . 82.3 mt -57.04 -54.16 49.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 174.676 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.429 ' HB2' HD13 ' A' ' 18' ' ' LEU . 23.3 tt0 -57.46 -47.72 81.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.514 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -63.76 -27.78 69.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.159 -176.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -79.43 -51.67 9.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.11 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.608 HG13 ' O ' ' A' ' 67' ' ' LEU . 5.3 m -66.79 -36.24 76.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.712 0.291 . . . . 0.0 110.878 -173.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.1 p -72.37 -38.28 68.57 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.638 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.1 p -62.18 -24.19 67.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.433 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 27.7 t -91.03 -49.95 6.13 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.507 -179.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 21' ' ' ASP . 71.9 mt -83.23 -21.19 33.47 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -172.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 72' ' ' THR . 35.2 mtp180 -85.96 0.54 52.98 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.412 0.625 . . . . 0.0 109.789 175.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -104.96 -39.02 6.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.673 169.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -152.52 95.69 2.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.095 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -69.73 123.79 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt 60.38 81.72 0.24 Allowed Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.749 -174.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.43 81.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.135 2.556 . . . . 0.0 112.971 -177.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -118.47 153.54 33.97 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.396 -0.812 . . . . 0.0 110.465 -179.249 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 8.8 p30 . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 120.829 0.347 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.0 27.49 9.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.347 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -63.54 110.31 1.94 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 173.103 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 58.3 p -74.26 153.99 39.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.215 0.531 . . . . 0.0 111.929 -172.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 11.2 t -81.66 85.16 6.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 46.8 mm -68.73 128.05 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.182 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.6 t -91.74 109.75 21.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.885 0.374 . . . . 0.0 110.657 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 206' ' ' LYS . . . . . 0.519 ' HZ3' ' HG2' ' A' ' 53' ' ' GLU . 8.3 tppt? -99.18 83.56 2.88 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 175.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -99.09 158.29 15.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.116 0.484 . . . . 0.0 110.637 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 208' ' ' LYS . . . . . 0.592 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 44.4 tttp -110.32 114.92 28.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.233 -178.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -91.84 129.55 41.79 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.96 115.86 2.98 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.589 2.193 . . . . 0.0 112.093 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 211' ' ' LEU . . . . . 0.426 HD12 ' HD2' ' B' ' 212' ' ' PRO . 21.3 tp -79.5 133.14 60.16 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.676 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 212' ' ' PRO . . . . . 0.426 ' HD2' HD12 ' B' ' 211' ' ' LEU . 60.5 Cg_endo -72.85 55.45 2.77 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.637 2.225 . . . . 0.0 112.28 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 43.7 tp -104.16 -11.49 17.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.541 0.686 . . . . 0.0 109.284 177.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 14.1 t -154.23 148.04 25.45 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.534 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -132.02 89.78 37.27 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.063 0.459 . . . . 0.0 110.523 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.01 154.14 57.81 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.981 2.454 . . . . 0.0 111.596 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.486 -1.175 . . . . 0.0 111.741 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.839 0.352 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -75.77 147.09 80.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.653 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.5 146.8 96.71 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.4 2.734 . . . . 0.0 112.906 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.72 129.08 34.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.879 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.0 p -72.55 177.45 4.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 177.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -60.7 -46.74 89.22 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.014 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -54.19 -44.26 71.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.015 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -61.39 -46.77 88.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.464 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.425 ' HE3' ' O ' ' A' ' 10' ' ' MET . 90.7 mttt -62.41 -34.21 76.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.549 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.9 ttp85 -68.42 -40.96 81.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.973 0.416 . . . . 0.0 110.08 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.44 -49.08 79.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.022 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.773 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -63.19 -34.83 78.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.214 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.3 t -63.91 -34.18 77.38 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.048 0.452 . . . . 0.0 110.449 173.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.9 mt -79.26 -41.47 28.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.438 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.773 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.9 p30 -65.77 -42.91 90.24 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.143 178.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.1 mt -59.33 -37.32 68.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -71.34 -23.92 62.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.626 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 51.2 mtpt -83.45 -14.25 52.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.054 0.454 . . . . 0.0 110.281 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG12 ' A' ' 71' ' ' VAL . 92.2 mt -79.76 137.73 54.37 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 95.1 Cg_endo -80.98 172.55 12.92 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 123.183 2.589 . . . . 0.0 113.156 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.84 -44.64 49.34 Favored Glycine 0 CA--C 1.519 0.321 0 O-C-N 123.361 0.413 . . . . 0.0 113.701 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 15.6 mp0 -50.16 -57.84 6.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.394 0.616 . . . . 0.0 111.175 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -74.17 -25.53 59.77 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.182 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.55 -26.89 68.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.124 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.44 93.34 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.208 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -76.61 -37.57 56.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.267 177.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.499 HG13 HD22 ' A' ' 67' ' ' LEU . 57.4 t -59.09 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.619 177.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.43 HG21 HD13 ' A' ' 52' ' ' ILE . 15.0 p -63.43 -28.72 45.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.533 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -67.46 -42.17 83.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.216 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.69 -46.35 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 33' ' ' VAL . 57.1 mt -60.1 -55.63 22.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.44 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 47' ' ' SER . 4.0 mt-30 -61.38 -40.98 96.32 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.5 t -74.28 -30.21 61.99 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.305 -0.247 . . . . 0.0 111.539 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.414 ' HD3' ' OE2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -82.3 -28.86 31.46 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.544 -0.463 . . . . 0.0 110.313 174.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -116.23 83.34 12.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.716 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.58 -16.01 52.07 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.41 2.074 . . . . 0.0 112.783 -178.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.2 t -74.01 -22.36 59.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 109.952 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.2 mt -96.42 25.98 4.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.395 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -63.12 -25.05 68.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -89.46 36.92 0.85 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.459 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.493 ' HB2' HE21 ' A' ' 38' ' ' GLN . 70.1 m -80.12 88.83 5.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 174.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 90.9 m-20 -62.61 124.5 83.27 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.965 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 89.4 Cg_exo -53.01 -23.09 20.5 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.463 2.775 . . . . 0.0 113.904 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.08 -23.37 48.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -147.66 72.62 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.259 0.224 . . . . 0.0 110.792 -174.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.43 HD13 HG21 ' A' ' 34' ' ' VAL . 23.0 mt -90.95 122.12 42.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.533 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -99.9 140.61 33.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.639 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 49.3 mt -112.54 107.69 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.51 92.66 4.14 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 122.23 1.014 . . . . 0.0 110.103 176.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -61.52 -15.93 42.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.229 -174.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -75.15 -22.32 58.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.495 -174.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -96.9 -26.72 14.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.0 mt -58.61 123.88 17.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.848 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.06 150.64 97.47 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.636 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -46.61 -29.5 7.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.483 2.122 . . . . 0.0 112.542 173.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 t -56.73 -55.36 35.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -63.77 -46.16 86.52 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.414 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -59.17 -37.2 76.77 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.093 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -73.25 -45.08 57.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.973 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 29.9 mt-10 -66.47 -38.29 87.0 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.679 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 71' ' ' VAL . 77.3 mt -60.36 -56.83 16.69 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.363 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 71' ' ' VAL . 18.1 tt0 -55.36 -41.83 73.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -58.43 -36.96 74.43 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.302 0.572 . . . . 0.0 110.534 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -82.77 -45.74 14.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.87 -175.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.586 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.4 m -63.19 -36.01 74.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.04 0.448 . . . . 0.0 110.403 -177.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 30.6 p -71.75 -39.95 69.69 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.335 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -64.82 -21.56 66.81 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.611 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.644 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 29.3 t -91.14 -53.14 4.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.762 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.521 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -79.51 -35.68 39.7 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -171.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 72' ' ' THR . 95.2 mtt180 -67.89 -31.43 71.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.4 tttp . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.033 177.381 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.407 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 4.4 t -100.81 149.87 5.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.13 -172.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -134.17 127.89 32.92 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -140.64 151.6 44.73 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.149 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.287 175.629 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.495 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 62.5 m . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 120.963 0.411 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.78 149.79 64.55 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.79 135.63 53.19 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 123.185 2.59 . . . . 0.0 112.42 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -70.04 135.02 48.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.5 p -76.76 176.18 8.71 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -61.86 -46.85 87.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.372 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -54.84 -44.66 74.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.112 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -64.7 -46.23 83.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.186 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -58.03 -44.24 87.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.179 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -63.86 -43.09 97.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.875 0.369 . . . . 0.0 110.275 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -57.62 -47.27 82.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.186 176.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -48.07 83.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.036 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.649 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 59.7 p -60.87 -35.87 77.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.796 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.9 -35.93 67.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.954 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.516 ' O ' HD11 ' A' ' 75' ' ' LEU . 1.1 m-20 -70.05 -42.23 73.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.427 177.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.1 mt -56.72 -38.22 56.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.318 0.58 . . . . 0.0 110.646 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.1 -25.25 64.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.576 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -82.11 -15.75 52.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.057 0.456 . . . . 0.0 110.637 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.473 HD23 HD21 ' A' ' 75' ' ' LEU . 92.1 mt -77.41 134.4 66.5 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.531 -176.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.504 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 92.1 Cg_endo -80.45 171.27 14.97 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 123.042 2.495 . . . . 0.0 113.252 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.3 -46.24 44.15 Favored Glycine 0 CA--C 1.52 0.365 0 O-C-N 123.377 0.423 . . . . 0.0 114.048 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -47.75 -51.99 20.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.09 0.471 . . . . 0.0 111.684 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.56 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -79.64 -30.13 41.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.088 -174.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.48 -27.07 68.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.52 -31.27 79.13 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.058 -0.591 . . . . 0.0 112.177 174.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 36' ' ' ILE . 17.1 tpp180 -81.69 -41.69 20.96 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.799 -0.236 . . . . 0.0 110.377 177.098 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 80.2 t -56.22 -54.12 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.84 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.1 -31.46 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.582 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.64 -41.68 92.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.867 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.2 mt -64.25 -50.98 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.107 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' VAL . 43.2 mt -56.24 -59.88 2.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.161 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -63.14 -34.4 77.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.8 m -77.69 -33.08 53.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 122.026 -0.421 . . . . 0.0 111.754 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -77.13 -30.12 55.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.093 0.473 . . . . 0.0 109.966 174.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 35.0 mm-40 -115.52 84.23 11.91 Favored Pre-proline 0 N--CA 1.446 -0.665 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.41 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.48 -13.97 40.89 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.398 2.066 . . . . 0.0 112.352 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.2 t -79.56 -11.15 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.134 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.0 mt -105.76 32.29 4.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.434 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -80.99 -1.76 45.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.235 0.54 . . . . 0.0 110.496 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -97.4 17.13 18.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.682 0.754 . . . . 0.0 109.659 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.9 m -75.86 95.74 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.903 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -54.82 122.9 43.31 Favored Pre-proline 0 C--N 1.331 -0.205 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 173.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.19 -16.88 23.41 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.889 2.393 . . . . 0.0 112.459 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -82.55 -36.79 25.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.247 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -131.92 62.02 1.64 Allowed 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.894 -176.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.505 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 24.0 mt -74.0 119.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.173 0.511 . . . . 0.0 111.458 -175.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -103.99 131.37 51.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.342 178.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 39.8 mt -106.87 109.67 28.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.27 101.92 11.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.101 0.953 . . . . 0.0 110.543 176.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.81 -6.9 44.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.312 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.74 -30.54 45.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.767 0.317 . . . . 0.0 110.765 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.5 p -90.16 -26.07 20.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.95 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.45 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 38.4 mt -59.32 127.38 31.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.637 176.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -72.91 148.17 89.21 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.854 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -43.79 -36.2 7.51 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.567 2.178 . . . . 0.0 113.201 175.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.492 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 33.5 t -54.6 -56.96 13.51 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 175.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.401 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.2 m -59.18 -47.8 83.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.456 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 59' ' ' LEU . 87.5 mt -57.18 -40.37 77.21 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.115 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 18.3 tpt180 -71.1 -46.92 60.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.023 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 62' ' ' SER . 41.5 mt-10 -65.61 -38.64 90.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.408 . . . . 0.0 110.458 -177.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.537 ' O ' HG13 ' A' ' 71' ' ' VAL . 93.2 mt -62.0 -55.97 23.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.244 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -53.83 -47.21 71.16 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.484 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 69' ' ' ARG . 35.2 ttp180 -52.7 -42.45 64.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.329 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -79.48 -47.84 14.93 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.832 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.1 m -63.79 -35.33 72.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.955 0.407 . . . . 0.0 110.381 -176.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 40.6 p -75.73 -36.69 59.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.828 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.3 p -66.56 -19.32 65.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.749 0.309 . . . . 0.0 110.601 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.56 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 24.4 t -90.44 -51.1 5.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.609 178.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.516 HD11 ' O ' ' A' ' 21' ' ' ASP . 81.3 mt -79.87 -36.8 36.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -173.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 46.1 mtp180 -79.18 -4.74 51.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.105 0.479 . . . . 0.0 110.711 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.0 tttm . . . . . 0 C--N 1.323 -0.568 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 172.585 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 44.3 mm . . . . . 0 C--O 1.231 0.131 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.649 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 88.8 t -104.88 122.91 58.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.419 -177.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 16.5 ttmm -107.09 117.34 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.507 171.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -127.79 141.88 51.46 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp . . . . . 0 C--N 1.316 -0.879 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.695 -179.349 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 120.795 0.331 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.03 154.33 60.55 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.609 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.59 128.92 24.77 Favored 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 123.172 2.581 . . . . 0.0 112.14 -176.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -61.34 130.06 44.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.189 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.8 p -73.65 173.88 9.13 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.75 -47.3 86.23 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.725 -174.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -53.7 -41.95 67.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.489 . . . . 0.0 111.081 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -67.56 -46.96 71.19 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.121 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.3 mttt -58.73 -42.22 88.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.259 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -62.0 -44.41 96.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.909 0.385 . . . . 0.0 110.336 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.99 -41.41 78.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.426 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.842 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 1.5 mt -67.0 -36.04 81.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.859 -176.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.4 p -65.74 -29.13 69.61 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.867 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.22 -42.41 31.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.842 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.4 p30 -67.85 -45.67 73.94 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.196 -0.201 . . . . 0.0 110.974 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mt -57.25 -34.21 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.365 0.603 . . . . 0.0 110.17 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -71.39 -29.37 64.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.434 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 55.4 mtpt -78.92 -22.37 45.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.035 0.445 . . . . 0.0 110.568 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 75' ' ' LEU . 86.6 mt -72.51 138.76 80.79 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.521 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 48.9 Cg_endo -83.81 172.63 9.85 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.475 2.783 . . . . 0.0 112.799 178.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.03 -44.38 62.32 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.548 -0.358 . . . . 0.0 113.466 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.3 mp0 -46.52 -52.06 14.14 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.615 0.721 . . . . 0.0 111.31 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.565 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.2 mptp? -83.51 -25.7 30.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.816 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.5 mt -64.07 -27.08 68.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.311 177.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.78 92.08 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.046 -0.597 . . . . 0.0 111.625 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -76.74 -42.86 39.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.561 0.22 . . . . 0.0 110.72 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.55 HG13 HD22 ' A' ' 67' ' ' LEU . 59.9 t -56.12 -52.07 54.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.961 0.41 . . . . 0.0 110.731 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 52' ' ' ILE . 8.0 p -65.14 -32.25 57.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.625 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -63.61 -42.43 98.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 79.3 mt -62.79 -49.06 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.316 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.51 -56.97 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -61.51 -32.97 73.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.9 t -80.16 -37.2 33.89 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.219 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.581 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -72.8 -35.6 67.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 120.972 0.415 . . . . 0.0 110.172 175.935 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.521 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 25.4 mm-40 -114.12 84.63 9.26 Favored Pre-proline 0 N--CA 1.442 -0.833 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.969 -175.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.2 -13.31 39.32 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.334 2.023 . . . . 0.0 112.33 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.0 m -79.06 -7.2 57.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.238 0.542 . . . . 0.0 110.353 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -110.88 25.62 11.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.32 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.77 -16.13 60.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.912 0.387 . . . . 0.0 110.844 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.72 28.14 1.6 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.86 0.362 . . . . 0.0 111.061 177.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 p -80.05 97.71 6.93 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -57.3 123.93 63.79 Favored Pre-proline 0 CA--C 1.516 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.95 -21.23 25.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 123.075 2.517 . . . . 0.0 113.15 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.61 -22.08 37.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.06 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -143.64 75.41 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.307 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.478 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -92.05 121.81 42.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.648 0.261 . . . . 0.0 111.091 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -104.21 137.34 42.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.737 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 54.2 mt -110.83 109.98 30.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.632 0.253 . . . . 0.0 110.58 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -110.53 98.78 7.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.933 0.873 . . . . 0.0 110.474 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -64.66 -16.36 62.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.582 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -74.16 -27.51 60.87 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.659 -176.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.08 -26.63 17.38 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.921 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.8 mt -56.53 128.64 37.19 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.238 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.521 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 24.0 mttm -70.84 149.23 95.05 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.822 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -46.46 -38.84 21.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.16 1.907 . . . . 0.0 112.35 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.8 m -56.61 -50.45 71.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.992 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.3 m -62.14 -48.22 81.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.395 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.02 -34.96 70.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -73.76 -50.54 20.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.128 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.581 ' OE1' ' HD3' ' A' ' 40' ' ' ARG . 40.9 mt-10 -62.41 -40.76 97.59 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.712 0.292 . . . . 0.0 110.779 -178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.599 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.2 mt -57.1 -60.35 3.73 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.357 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.629 ' OE2' HG23 ' A' ' 72' ' ' THR . 6.1 tp10 -51.92 -52.35 50.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.346 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -55.9 -36.5 67.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.051 0.453 . . . . 0.0 110.941 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.13 -48.19 18.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.845 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -63.55 -36.19 75.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.825 0.345 . . . . 0.0 110.62 -175.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.629 HG23 ' OE2' ' A' ' 68' ' ' GLU . 0.9 OUTLIER -67.74 -39.26 84.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.1 p -65.62 -23.15 66.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.812 0.339 . . . . 0.0 110.573 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.565 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 49.1 t -90.01 -47.11 8.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.973 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 25' ' ' LEU . 74.8 mt -87.8 -44.17 11.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' THR . 90.4 mtt180 -66.83 -26.03 66.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.803 0.335 . . . . 0.0 111.208 -176.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.7 mttp . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.17 178.904 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 204' ' ' ILE . . . . . 0.438 HD12 ' N ' ' B' ' 204' ' ' ILE . 2.3 mp . . . . . 0 C--O 1.235 0.333 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.33 163.24 2.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.158 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 0.0 OUTLIER -159.24 141.85 14.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.114 169.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -140.93 159.62 41.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.896 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.846 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.8 m . . . . . 0 C--O 1.234 0.28 0 CA-C-O 121.201 0.524 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.12 145.46 99.0 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.916 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -64.75 152.63 81.32 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.901 2.4 . . . . 0.0 112.066 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.3 mmt -85.86 130.51 34.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.519 -178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 p -77.8 178.2 7.57 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 175.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.29 -49.59 77.27 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.728 -174.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.13 -49.63 63.33 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 109.711 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.41 -44.93 96.29 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.842 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -60.38 -41.81 94.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.402 177.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -64.73 -41.54 95.88 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.826 0.346 . . . . 0.0 110.396 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -57.49 -47.56 81.58 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.556 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -61.91 -41.06 97.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.731 178.986 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.9 p -63.81 -25.32 68.12 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.211 -0.93 . . . . 0.0 110.449 176.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.9 mt -84.73 -42.99 14.71 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.448 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.603 ' OD1' HG21 ' A' ' 71' ' ' VAL . 1.1 p30 -67.4 -41.36 85.06 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 121.258 -0.177 . . . . 0.0 110.785 177.206 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -58.43 -40.57 78.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.015 0.436 . . . . 0.0 110.269 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -68.34 -30.92 69.99 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 39.9 mttp -62.07 -35.37 78.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.978 0.418 . . . . 0.0 111.346 173.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.625 HD11 HG12 ' A' ' 71' ' ' VAL . 95.0 mt -68.35 135.79 91.06 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.549 -0.751 . . . . 0.0 112.313 -172.011 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.2 Cg_endo -80.83 172.09 13.59 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.342 2.695 . . . . 0.0 112.803 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.52 -43.46 52.69 Favored Glycine 0 C--O 1.237 0.332 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.378 -175.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 5.5 mp0 -48.62 -55.87 10.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.522 0.677 . . . . 0.0 111.148 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.584 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -80.37 -27.06 38.3 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.445 -174.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.0 mt -62.64 -27.75 69.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.626 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.574 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 36' ' ' ILE . 12.6 tpp180 -66.24 -41.52 89.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.671 0.272 . . . . 0.0 110.675 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 67' ' ' LEU . 93.7 t -56.85 -52.14 58.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.88 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 30' ' ' LEU . 22.2 t -64.17 -36.84 78.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.455 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -59.45 -41.63 90.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.206 177.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.1 mt -66.73 -48.69 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.24 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 33' ' ' VAL . 55.0 mt -58.88 -55.83 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.036 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 37.2 mt-30 -62.3 -34.1 75.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.3 t -78.28 -36.13 47.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -176.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.62 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 5.9 mpt_? -80.32 -27.88 38.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.424 177.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.635 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 60.0 mm-40 -114.21 87.05 12.66 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.851 178.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.12 -13.1 35.79 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.125 1.883 . . . . 0.0 112.109 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.9 t -72.7 -20.95 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.232 0.539 . . . . 0.0 109.803 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.1 mt -104.1 33.82 3.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.228 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -72.74 -17.65 61.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.505 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.71 41.86 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.778 0.799 . . . . 0.0 110.062 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.9 m -88.51 91.01 8.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.424 177.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 87.2 m-20 -60.04 123.22 71.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.19 177.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 59.4 Cg_exo -56.24 -19.04 26.09 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.253 2.635 . . . . 0.0 113.147 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.19 -27.82 38.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -146.85 78.67 1.5 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.921 -176.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 23.2 mt -92.25 125.74 44.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.205 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -104.55 119.63 39.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.651 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.446 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 48.2 mt -96.87 109.42 23.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.238 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 17.0 p-10 -109.39 98.62 7.99 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.931 0.872 . . . . 0.0 110.078 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -68.89 -0.35 5.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.802 -175.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -85.6 -24.69 27.06 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.95 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.2 p -101.78 -26.01 13.62 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.529 HD23 ' HG3' ' A' ' 41' ' ' GLU . 31.3 mt -53.8 128.78 31.2 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.647 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.635 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 23.1 mttm -71.91 150.99 92.97 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.657 178.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -47.11 -36.5 21.43 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.296 1.997 . . . . 0.0 112.426 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 25.6 t -54.4 -54.43 40.73 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.0 -49.62 76.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.668 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -57.38 -37.64 72.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.306 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.6 -45.97 23.55 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.085 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.7 mt-10 -63.92 -36.66 84.67 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.789 0.328 . . . . 0.0 110.457 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.538 HD22 HG13 ' A' ' 33' ' ' VAL . 83.6 mt -62.2 -56.1 22.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.116 174.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.16 -46.83 75.76 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.144 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -63.03 -31.93 73.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.795 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -78.53 -47.78 16.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.612 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.625 HG12 HD11 ' A' ' 25' ' ' LEU . 15.7 m -63.12 -42.47 96.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.14 0.495 . . . . 0.0 110.471 -176.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.404 ' N ' HG23 ' A' ' 71' ' ' VAL . 24.7 p -63.91 -36.66 84.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.933 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 82.9 p -67.73 -24.23 65.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.584 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.3 t -91.14 -32.35 15.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.433 -177.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.601 HD21 HD23 ' A' ' 25' ' ' LEU . 28.1 mt -97.79 -43.05 7.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.404 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 20.9 mtp180 -71.46 -10.7 60.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 110.377 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.283 176.284 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 204' ' ' ILE . . . . . 0.415 HD12 ' N ' ' B' ' 204' ' ' ILE . 4.0 mp . . . . . 0 CA--C 1.521 -0.16 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.446 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 26.9 t -104.9 105.31 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.337 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.2 ttmm -96.01 118.02 31.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.456 ' CZ ' HD22 ' A' ' 30' ' ' LEU . 10.3 p90 -131.75 137.32 48.15 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.67 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 59.0 mttm . . . . . 0 C--N 1.317 -0.808 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.438 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 m . . . . . 0 N--CA 1.454 -0.253 0 CA-C-O 120.942 0.401 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -75.94 145.19 77.25 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.584 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.9 124.34 13.41 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.494 2.129 . . . . 0.0 110.962 176.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.495 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.2 mmt -57.6 128.7 38.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 p -73.07 175.61 6.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.892 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.311 -174.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -56.3 -40.18 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.158 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.11 -46.4 81.16 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.719 178.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.0 mttt -60.98 -39.56 90.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.394 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -64.2 -44.74 91.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -58.38 -44.24 88.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.829 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.93 -39.89 79.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.819 -176.592 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.49 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 87.5 p -63.48 -25.77 68.41 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.715 -0.615 . . . . 0.0 110.328 175.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.2 mt -82.69 -44.76 15.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.164 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.829 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.6 p30 -62.09 -41.19 97.94 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.409 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.437 ' HA ' HD12 ' A' ' 25' ' ' LEU . 84.6 mt -62.94 -40.11 87.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.907 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -68.42 -28.5 67.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.962 0.411 . . . . 0.0 111.213 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.5 mtpp -78.25 -16.88 57.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 84.5 mt -79.3 132.56 62.35 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.619 -176.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 78.3 Cg_endo -76.69 172.18 16.68 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 123.199 2.599 . . . . 0.0 113.085 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.03 -45.54 50.98 Favored Glycine 0 C--N 1.334 0.442 0 O-C-N 123.301 0.376 . . . . 0.0 113.927 -172.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -49.79 -55.31 14.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.415 0.626 . . . . 0.0 110.993 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.9 mptp? -76.5 -31.43 57.71 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.944 -174.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mt -58.39 -31.05 67.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.489 175.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.25 -34.53 89.48 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.268 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -79.03 -39.91 32.79 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.584 0.23 . . . . 0.0 110.499 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.542 HG13 HD22 ' A' ' 67' ' ' LEU . 93.3 t -56.18 -55.09 20.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.685 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.544 HG21 HD13 ' A' ' 52' ' ' ILE . 12.0 p -63.63 -30.77 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.638 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -65.26 -41.77 93.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.908 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.8 mt -65.99 -41.22 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.903 177.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.527 HG23 HD21 ' A' ' 59' ' ' LEU . 72.8 mt -62.41 -60.56 2.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.218 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -65.83 -29.67 70.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -78.28 -38.79 41.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.05 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.462 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 9.6 mpt_? -76.4 -31.92 58.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.577 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.633 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 49.4 mm-40 -112.72 85.26 7.35 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.441 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.76 -12.26 30.71 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.363 2.042 . . . . 0.0 112.567 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -82.29 -5.27 58.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 0.0 110.574 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.5 mt -115.63 27.42 9.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.02 177.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -80.3 -17.14 52.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.252 0.549 . . . . 0.0 110.476 -174.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -92.85 20.66 6.34 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.807 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 66.8 m -68.78 105.26 2.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.177 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.644 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -50.6 120.86 13.57 Favored Pre-proline 0 N--CA 1.463 0.187 0 O-C-N 123.118 0.262 . . . . 0.0 110.534 171.576 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.7 Cg_exo -59.08 -23.08 67.25 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.787 2.325 . . . . 0.0 111.556 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 21.9 m-20 -71.77 -35.96 70.21 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.643 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB2' ' OD1' ' A' ' 48' ' ' ASN . 20.5 mm-40 -138.64 72.1 1.4 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.035 0.379 . . . . 0.0 111.041 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.544 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -82.79 120.7 34.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.009 0.433 . . . . 0.0 111.136 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 19.0 mm-40 -100.84 122.69 43.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.053 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.5 mt -91.04 108.76 20.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.952 175.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -107.19 98.85 8.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.163 0.982 . . . . 0.0 110.309 177.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HD1' ' CD2' ' A' ' 64' ' ' LEU . 93.5 m-85 -70.67 -1.04 10.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.137 -174.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -84.35 -29.28 26.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.932 0.396 . . . . 0.0 110.765 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.6 p -90.7 -32.21 16.27 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' A' ' 41' ' ' GLU . 33.3 mt -53.18 126.98 22.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.118 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.633 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 27.5 mttm -66.03 147.58 98.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.5 -30.44 21.19 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.362 2.042 . . . . 0.0 111.762 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.482 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 13.6 m -60.51 -52.23 66.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 174.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -61.13 -46.46 90.47 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.461 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.4 ' CD2' ' HD1' ' A' ' 56' ' ' PHE . 78.6 mt -58.87 -39.18 80.62 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.843 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -68.23 -48.24 65.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.075 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 62' ' ' SER . 17.3 mm-40 -66.48 -40.72 89.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.853 -178.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.542 HD22 HG13 ' A' ' 33' ' ' VAL . 75.6 mt -57.15 -55.39 35.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.682 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -54.08 -42.4 69.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.91 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -59.86 -43.03 94.92 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.326 0.584 . . . . 0.0 110.167 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -74.88 -46.55 35.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.969 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.572 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.2 m -63.9 -38.1 81.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.074 0.464 . . . . 0.0 110.727 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.7 p -72.8 -38.44 67.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.056 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.2 p -64.84 -19.57 65.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 31.4 t -90.84 -54.83 3.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.65 177.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -78.85 -27.46 44.16 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 57.1 mtp180 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.621 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 tttt . . . . . 0 C--N 1.324 -0.512 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 172.773 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 10.6 pt . . . . . 0 C--O 1.234 0.273 0 CA-C-O 120.931 0.396 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.49 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 61.3 t -121.12 113.82 41.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.633 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.496 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 19.5 ttmm -92.67 116.65 29.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -129.57 143.31 50.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.245 0.545 . . . . 0.0 110.55 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 44.1 mttp . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.355 176.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.7 m . . . . . 0 C--O 1.236 0.352 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.56 144.41 97.69 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 170.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.9 129.57 21.12 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.78 2.32 . . . . 0.0 110.993 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.541 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -64.67 128.14 34.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.567 -177.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.4 p -73.53 174.45 8.23 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.7 -46.7 88.28 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.475 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.84 -44.23 77.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.368 . . . . 0.0 111.042 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -63.32 -46.09 88.29 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.913 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.6 mttt -61.25 -39.26 89.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.497 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.8 ttp180 -62.91 -43.62 98.29 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -56.75 -46.13 81.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.167 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.565 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -65.65 -33.17 75.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.464 -175.116 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.4 p -70.1 -27.16 64.37 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.51 -0.744 . . . . 0.0 109.986 175.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 85.8 mt -80.91 -46.01 15.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.201 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.587 ' CG ' HG21 ' A' ' 71' ' ' VAL . 1.3 p30 -65.44 -42.27 92.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.21 -0.196 . . . . 0.0 111.302 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' A' ' 25' ' ' LEU . 35.1 mt -60.37 -41.5 87.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.016 0.436 . . . . 0.0 110.493 176.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -65.14 -24.12 67.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.585 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.6 mtpp -85.89 -7.63 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.476 HD11 HG12 ' A' ' 71' ' ' VAL . 80.4 mt -86.23 137.67 34.78 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.571 -177.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -80.32 167.31 19.56 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.259 2.639 . . . . 0.0 112.841 177.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.01 -46.1 41.72 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 114.39 0.516 . . . . 0.0 114.39 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -53.67 -51.28 63.69 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.451 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.755 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -73.19 -32.73 64.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.642 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.553 HD21 ' CD1' ' B' ' 207' ' ' PHE . 10.6 tp -62.59 -24.63 67.66 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.65 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.87 99.51 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.909 -0.662 . . . . 0.0 111.493 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.1 tpm_? -67.85 -40.99 83.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.217 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.533 HG13 HD22 ' A' ' 67' ' ' LEU . 61.2 t -59.0 -58.15 8.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.008 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.13 -27.65 42.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.796 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -68.29 -41.96 80.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.301 -0.409 . . . . 0.0 109.964 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.58 HG13 ' HE ' ' A' ' 32' ' ' ARG . 61.8 mt -62.11 -43.47 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 120.974 0.416 . . . . 0.0 110.31 177.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.487 HG12 HD11 ' A' ' 67' ' ' LEU . 53.2 mt -65.02 -58.5 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.402 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 25.0 mt-30 -63.07 -28.47 70.11 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -173.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -89.95 -27.74 19.61 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.489 -0.484 . . . . 0.0 112.123 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 40' ' ' ARG . 5.0 mpt_? -81.89 -22.94 36.59 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.355 171.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -125.0 65.12 46.39 Favored Pre-proline 0 N--CA 1.442 -0.867 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.936 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -52.47 -17.93 7.4 Favored 'Trans proline' 0 N--CA 1.478 0.601 0 C-N-CA 122.971 2.447 . . . . 0.0 113.284 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.4 m -66.3 -21.85 66.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.963 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.59 41.95 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.036 0.446 . . . . 0.0 110.306 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -73.56 -15.55 61.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.154 -174.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -96.52 35.1 1.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.875 0.369 . . . . 0.0 111.213 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 50.2 m -81.33 89.38 6.08 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 175.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.441 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 86.3 m-20 -61.35 123.44 76.23 Favored Pre-proline 0 CA--C 1.52 -0.209 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.126 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 71.1 Cg_exo -53.17 -21.74 17.68 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.654 2.903 . . . . 0.0 114.268 -174.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 4.6 p-10 -76.11 -36.3 58.92 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.875 -177.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -143.7 77.5 1.56 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.449 HD12 ' CE1' ' B' ' 207' ' ' PHE . 26.2 mt -85.84 128.42 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.214 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -101.15 117.87 35.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 52.8 mt -90.38 108.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' B' ' 204' ' ' ILE . 12.2 t70 -105.11 99.15 8.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -68.18 -13.37 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.547 -172.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -79.38 -35.26 41.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.789 0.328 . . . . 0.0 110.559 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.4 p -80.91 -21.89 40.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.994 176.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 25.0 mt -67.16 135.62 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.494 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -76.54 147.45 78.64 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.005 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -42.94 -40.46 8.45 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.929 2.42 . . . . 0.0 113.05 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -58.13 -50.22 74.25 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.036 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -47.91 83.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.263 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.82 -37.56 71.37 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.023 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -70.63 -52.11 23.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.174 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -62.99 -39.34 94.44 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 111.059 -177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.533 HD22 HG13 ' A' ' 33' ' ' VAL . 85.9 mt -60.24 -57.97 10.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.682 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.513 ' HA ' HG22 ' A' ' 71' ' ' VAL . 7.9 tt0 -58.77 -45.79 88.99 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.726 0.298 . . . . 0.0 111.155 -178.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -57.67 -30.15 65.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.259 0.552 . . . . 0.0 110.295 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 65.1 t80 -82.88 -49.2 9.91 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.919 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.587 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.0 m -60.81 -36.18 69.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.239 0.543 . . . . 0.0 110.482 -176.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.494 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 22.3 p -69.95 -39.91 75.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 92.4 p -65.63 -20.07 66.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.795 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.755 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.5 t -90.76 -53.49 4.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.762 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.47 HD21 HD23 ' A' ' 25' ' ' LEU . 71.1 mt -77.28 -36.0 54.66 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -172.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 72' ' ' THR . 98.3 mtt180 -75.33 -7.62 54.46 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.249 0.547 . . . . 0.0 110.472 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 57.7 tttp . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.166 176.358 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 204' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 55' ' ' ASP . 39.3 mm . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.954 0.407 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.442 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 58.2 t -85.27 117.73 30.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.328 -174.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -105.63 77.95 1.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.605 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.553 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.0 p90 -92.01 158.16 16.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.217 0.532 . . . . 0.0 110.478 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 12.4 mptt . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.624 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.7 m . . . . . 0 N--CA 1.45 -0.433 0 CA-C-O 120.903 0.382 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -75.75 144.78 77.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.34 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.51 135.93 51.97 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.847 2.365 . . . . 0.0 111.534 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -72.66 131.29 42.22 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.826 -175.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 p -76.06 176.71 7.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.782 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.33 -47.88 84.12 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.597 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -53.09 -47.61 68.42 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.399 0.618 . . . . 0.0 110.024 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -63.86 -45.03 91.29 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.963 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 96.2 mttt -59.2 -44.6 92.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.396 175.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.475 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 50.0 ttp85 -59.48 -47.62 84.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.163 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -58.85 -51.94 67.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.968 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.68 -49.82 67.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.827 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 93.5 p -62.57 -30.81 71.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.918 0.389 . . . . 0.0 111.076 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 94.0 mt -73.55 -41.98 62.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.798 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 23.0 m-20 -67.26 -41.51 85.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.291 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' HD12 ' A' ' 25' ' ' LEU . 95.6 mt -58.1 -41.83 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -66.65 -27.59 67.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.532 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.92 -24.82 43.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.061 0.458 . . . . 0.0 110.451 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 75' ' ' LEU . 93.1 mt -66.67 135.49 94.46 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.398 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.8 Cg_endo -80.49 170.08 16.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.951 2.434 . . . . 0.0 112.858 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.59 -44.0 46.35 Favored Glycine 0 CA--C 1.519 0.329 0 O-C-N 123.195 0.309 . . . . 0.0 113.327 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.3 mp0 -45.43 -54.09 7.83 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.5 0.667 . . . . 0.0 111.203 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.665 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -82.71 -29.42 29.84 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.91 -175.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.74 -27.64 68.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.443 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.3 -28.85 71.6 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.139 174.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.464 ' O ' HG13 ' A' ' 36' ' ' ILE . 14.5 tpp180 -84.31 -43.04 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 122.585 -0.362 . . . . 0.0 110.335 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 43.4 t -55.07 -54.16 26.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.49 -29.86 48.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.526 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -66.01 -39.86 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.638 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.5 mt -66.93 -49.97 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.949 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' VAL . 50.0 mt -56.95 -59.73 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.089 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -62.48 -32.46 73.36 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.9 t -80.24 -32.57 38.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -82.58 -25.13 33.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 121.92 -0.488 . . . . 0.0 110.21 175.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.8 mm-40 -117.58 82.08 15.31 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.523 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.11 -15.11 45.91 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.584 2.189 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.9 t -78.31 -24.26 46.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 109.761 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.55 17.94 5.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.199 0.523 . . . . 0.0 110.22 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -74.0 -10.73 59.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.476 0.655 . . . . 0.0 109.683 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -84.22 4.93 28.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.257 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.0 m -67.48 97.84 0.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.299 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 89.8 m-20 -60.34 122.81 69.93 Favored Pre-proline 0 N--CA 1.452 -0.354 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 79.0 Cg_exo -52.09 -26.03 24.6 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.664 2.909 . . . . 0.0 113.451 -174.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -71.01 -29.68 65.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.186 -177.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -143.65 76.07 1.5 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.944 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.7 mt -88.4 126.91 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -108.1 132.55 53.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.775 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.0 mt -104.02 108.84 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 174.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -110.87 97.27 6.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.923 0.868 . . . . 0.0 110.601 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -68.12 -9.27 45.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.937 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -21.4 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.472 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.5 p -99.02 -25.24 14.62 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.47 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 23.3 mt -57.9 130.42 46.45 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.388 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -74.32 148.18 85.89 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.93 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -48.1 -33.93 22.31 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.75 2.3 . . . . 0.0 112.398 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.6 m -57.82 -53.32 59.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.46 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -62.33 -48.45 79.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.739 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.24 -36.68 71.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -69.44 -50.24 47.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.816 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.35 -38.94 91.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.548 ' O ' HG13 ' A' ' 71' ' ' VAL . 85.1 mt -61.22 -56.03 25.26 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.342 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -55.14 -49.77 70.96 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.802 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -55.68 -38.34 69.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.674 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -75.85 -50.08 16.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.726 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.548 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -62.82 -35.79 72.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 -175.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.511 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.7 p -74.61 -38.46 62.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.663 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.6 p -64.99 -19.43 65.99 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.559 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.665 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.4 t -91.02 -55.02 3.71 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.74 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 25' ' ' LEU . 75.1 mt -74.28 -34.5 63.57 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -174.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 72' ' ' THR . 28.2 mtp180 -80.07 8.77 6.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.276 0.56 . . . . 0.0 110.226 177.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.9 tttt . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.856 171.776 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 19.8 mm . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 121.403 0.62 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.427 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 39.6 t -82.36 133.93 28.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.842 -175.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -116.65 119.9 36.97 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -129.86 137.88 50.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.155 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 68.3 mttm . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.952 -179.679 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.3 m . . . . . 0 C--O 1.237 0.398 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -72.36 144.32 86.64 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.046 173.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -66.36 124.23 12.22 Favored 'Trans proline' 0 C--O 1.236 0.383 0 C-N-CA 122.801 2.334 . . . . 0.0 111.667 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -58.75 125.76 24.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.904 -176.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 p -72.49 175.22 6.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.15 -49.24 78.63 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.874 0.306 . . . . 0.0 110.356 -175.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -55.12 -41.74 72.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.08 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.85 -46.02 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.938 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.67 -42.89 89.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.416 176.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -63.95 -43.5 95.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.298 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -58.85 -43.06 90.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.369 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -65.64 -38.4 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.275 -177.44 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.8 p -64.55 -28.13 69.43 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 119.979 -0.689 . . . . 0.0 110.093 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.59 -41.21 19.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.459 -178.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.687 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -67.47 -40.87 85.32 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.682 177.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.7 mt -58.78 -40.07 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.093 0.473 . . . . 0.0 110.197 175.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -69.87 -29.4 66.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.824 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 47.2 mttp -64.13 -34.18 77.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.247 0.546 . . . . 0.0 110.966 173.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.671 HD11 HG12 ' A' ' 71' ' ' VAL . 95.4 mt -69.26 131.0 90.61 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.214 -172.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -77.54 172.9 15.04 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 123.525 2.817 . . . . 0.0 112.431 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.33 -45.94 52.38 Favored Glycine 0 CA--C 1.518 0.266 0 O-C-N 123.324 0.39 . . . . 0.0 113.846 -172.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.534 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 9.0 mp0 -47.26 -52.47 15.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.643 0.735 . . . . 0.0 111.034 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.577 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 2.1 mptp? -78.36 -23.8 46.72 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.155 -173.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.462 ' HA ' HD23 ' A' ' 30' ' ' LEU . 11.4 mt -62.11 -27.37 68.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.124 177.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.29 -35.99 92.41 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.067 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 36' ' ' ILE . 15.5 tpp180 -78.92 -40.83 31.08 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.199 -0.201 . . . . 0.0 110.698 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.5 t -57.3 -53.62 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.59 -30.71 51.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.963 0.411 . . . . 0.0 110.357 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -65.89 -40.98 92.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.962 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 32' ' ' ARG . 64.8 mt -65.85 -50.89 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.975 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.8 mt -58.56 -58.59 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 -178.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -61.01 -32.53 72.12 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.7 t -79.62 -38.68 33.29 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -176.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 9.1 mpt_? -75.6 -27.83 58.67 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.074 176.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.6 mm-40 -115.78 84.16 12.53 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.122 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.82 -12.83 36.08 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.363 2.042 . . . . 0.0 111.966 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.4 m -79.76 -8.62 59.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.375 177.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.6 mt -113.1 26.96 10.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.09 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -69.69 -23.39 63.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.403 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.69 21.43 1.53 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.024 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.0 m -75.1 91.08 2.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.83 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -53.0 125.86 41.63 Favored Pre-proline 0 CA--C 1.52 -0.211 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.998 173.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.27 -15.18 17.74 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.836 2.357 . . . . 0.0 112.159 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.514 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 16.7 m-20 -85.2 -29.79 24.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.555 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -139.6 59.68 1.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.697 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 18.9 mt -69.64 125.0 26.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.083 0.468 . . . . 0.0 111.508 -175.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -104.93 126.33 51.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.616 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 60.2 mt -107.28 108.3 24.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 173.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.455 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.5 p-10 -110.53 103.6 12.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.83 0.824 . . . . 0.0 110.762 176.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -69.68 -12.28 61.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.556 -174.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -74.56 -27.68 60.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.458 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.1 p -95.54 -28.03 15.07 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.097 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.6 mt -56.62 127.1 29.7 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 177.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -71.46 146.95 92.27 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -43.5 -32.85 3.92 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.864 2.376 . . . . 0.0 113.004 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.46 -54.72 43.87 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.686 0.279 . . . . 0.0 110.645 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -60.88 -47.73 85.03 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.234 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.3 mt -55.74 -39.87 71.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.92 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.3 tpt180 -70.47 -49.25 50.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.244 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -63.8 -36.56 84.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.775 0.321 . . . . 0.0 110.632 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.551 ' O ' HG13 ' A' ' 71' ' ' VAL . 84.8 mt -60.82 -56.46 20.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.998 174.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -54.48 -43.03 71.4 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.99 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -60.16 -39.29 85.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.375 0.607 . . . . 0.0 110.35 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -75.85 -47.07 27.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.775 -176.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.671 HG12 HD11 ' A' ' 25' ' ' LEU . 11.7 m -64.08 -42.71 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.07 0.462 . . . . 0.0 110.641 -175.051 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 25.3 p -67.69 -32.29 72.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.491 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.7 t -66.15 -25.32 66.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.263 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.7 t -91.72 -45.37 8.47 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.977 0.418 . . . . 0.0 110.414 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 25' ' ' LEU . 26.7 mt -85.51 -28.5 24.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -169.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 30.7 mtp180 -80.43 8.8 6.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.476 0.655 . . . . 0.0 110.116 177.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.9 tttp . . . . . 0 N--CA 1.449 -0.483 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.077 170.486 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 58.3 mt . . . . . 0 C--O 1.235 0.323 0 CA-C-O 121.14 0.495 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.499 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 47.3 t -92.91 108.03 19.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.62 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 4.4 ttmp? -104.28 109.8 21.77 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.135 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -126.84 151.1 48.8 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.044 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 67.6 mttm . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.6 m . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 120.922 0.391 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -68.27 144.17 96.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.26 149.72 88.23 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.843 2.362 . . . . 0.0 112.075 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -85.95 119.89 26.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 p -67.6 174.64 3.35 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -46.95 84.29 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.762 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -51.26 -48.7 62.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.682 0.753 . . . . 0.0 109.943 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -65.15 -46.06 82.47 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.062 -175.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.03 -38.98 73.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.268 176.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 16' ' ' ARG . 39.1 ttp180 -62.76 -44.37 96.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.327 175.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -59.74 -43.47 94.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.502 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.778 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -66.42 -38.06 86.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.305 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.7 p -65.37 -26.8 68.17 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.628 -0.67 . . . . 0.0 110.359 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.86 -43.87 19.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.396 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.778 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -64.09 -43.8 94.26 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.775 178.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.21 -41.96 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.931 0.396 . . . . 0.0 110.724 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -70.25 -27.44 64.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -74.5 -33.97 62.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.491 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.561 HD23 HD21 ' A' ' 75' ' ' LEU . 77.9 mt -56.94 138.19 79.13 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.333 -175.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.693 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 59.0 Cg_endo -79.22 163.24 25.22 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 123.521 2.814 . . . . 0.0 111.583 178.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.31 -27.15 60.13 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.151 -0.931 . . . . 0.0 114.855 -169.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.514 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.4 mp0 -63.07 -54.47 37.46 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.594 0.697 . . . . 0.0 109.711 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.693 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 3.8 mptt -72.22 -26.7 62.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.902 -176.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.4 mt -63.02 -25.7 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.014 176.185 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.26 -33.57 86.46 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.944 174.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.44 ' O ' HG13 ' A' ' 36' ' ' ILE . 9.0 tpp180 -79.96 -41.99 24.86 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 122.752 -0.264 . . . . 0.0 110.37 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -56.36 -52.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.472 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.83 -31.24 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.477 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -66.18 -42.14 89.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.998 176.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.1 mt -65.93 -51.4 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.6 mt -57.72 -59.31 3.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.779 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.424 ' OE1' ' HA ' ' A' ' 45' ' ' LYS . 9.9 mt-30 -61.93 -33.74 74.81 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -76.56 -36.28 57.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.592 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -78.47 -31.24 47.79 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.075 0.464 . . . . 0.0 110.024 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.492 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 16.5 mm-40 -116.33 83.26 12.8 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.105 -177.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.89 -15.13 48.84 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.389 2.059 . . . . 0.0 112.456 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -74.52 -19.75 60.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.987 0.422 . . . . 0.0 110.199 177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -95.5 19.01 11.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.424 ' HA ' ' OE1' ' A' ' 38' ' ' GLN . 55.1 tttm -69.98 -9.12 54.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.275 0.56 . . . . 0.0 110.598 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -87.14 11.0 15.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.916 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.5 m -72.81 91.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 46.9 m-80 -62.96 121.76 70.73 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 76.8 Cg_exo -46.99 -34.89 17.47 Favored 'Trans proline' 0 N--CA 1.477 0.526 0 C-N-CA 124.202 3.268 . . . . 0.0 114.977 -170.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.75 -22.44 61.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 111.526 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -140.55 70.65 1.36 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.05 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.4 mt -86.33 121.21 37.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.846 0.355 . . . . 0.0 110.772 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -104.51 126.55 51.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.615 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.411 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.8 mt -103.66 109.79 28.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 120.655 0.264 . . . . 0.0 110.551 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -107.15 99.13 8.7 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.157 0.98 . . . . 0.0 110.626 175.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -68.14 -4.32 13.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.739 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -80.01 -22.66 42.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.602 0.239 . . . . 0.0 110.823 -178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -101.17 -24.42 14.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.782 0.325 . . . . 0.0 110.153 176.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 37.4 mt -59.46 125.2 22.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.071 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.32 149.6 91.56 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.051 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -42.7 -36.43 4.94 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.722 2.281 . . . . 0.0 113.452 174.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 m -56.92 -55.02 39.92 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.411 0.148 . . . . 0.0 111.215 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.407 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.7 m -59.84 -46.11 90.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.208 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.96 -37.32 76.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -73.77 -44.81 54.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.5 -39.83 92.34 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.848 0.356 . . . . 0.0 110.435 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.539 ' O ' HG13 ' A' ' 71' ' ' VAL . 90.8 mt -60.67 -55.79 29.05 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.27 175.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -55.77 -45.9 78.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.341 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.06 -39.09 77.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -77.44 -47.16 20.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.038 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.554 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.6 m -62.72 -36.56 75.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.078 0.466 . . . . 0.0 110.735 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.0 p -72.22 -30.71 65.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.701 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -71.79 -19.97 61.93 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.862 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.492 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 47.6 t -90.95 -51.86 5.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.766 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.561 HD21 HD23 ' A' ' 25' ' ' LEU . 65.5 mt -79.21 -37.96 36.89 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 31.5 mtp180 -79.51 -5.53 55.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.75 -177.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.2 tttt . . . . . 0 C--N 1.324 -0.508 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.931 176.705 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 68.6 mt . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.411 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 44.2 t -92.74 103.34 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.138 -175.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.7 ttmm -93.91 100.83 12.92 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.273 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -105.47 124.1 48.99 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.561 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 64.3 mttm . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.705 -177.122 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 120.944 0.402 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -73.49 141.67 80.23 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.45 123.66 14.29 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 123.115 2.543 . . . . 0.0 112.016 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.4 mmt -57.63 132.41 53.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.145 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 p -77.75 174.77 10.61 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.47 -45.96 84.21 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 109.919 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -56.41 -44.86 80.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.816 -179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.69 -47.09 79.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.432 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -57.79 -40.4 79.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.277 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.5 ttp-105 -59.97 -45.43 92.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.238 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -61.78 -41.43 97.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.383 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.725 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.11 -41.16 82.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.925 -178.234 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.444 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 98.5 p -63.15 -25.16 68.22 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.526 -0.734 . . . . 0.0 110.592 175.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.9 mt -82.24 -45.28 15.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.633 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.725 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -61.78 -42.25 98.75 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.82 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.425 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.4 mt -59.65 -40.69 82.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.067 0.461 . . . . 0.0 110.656 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -71.33 -20.11 62.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.307 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.7 mtpp -85.15 -14.86 45.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.13 0.491 . . . . 0.0 110.437 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.547 HD11 HG12 ' A' ' 71' ' ' VAL . 92.7 mt -80.03 139.69 53.34 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.189 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.556 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 98.6 Cg_endo -80.61 171.84 14.12 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 123.206 2.604 . . . . 0.0 112.983 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.68 -38.68 64.54 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.622 -0.323 . . . . 0.0 113.33 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 11.1 mp0 -50.53 -56.39 11.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.603 0.716 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.613 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.3 mptp? -78.24 -27.91 47.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.595 -175.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.08 -31.06 64.85 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.745 175.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.39 -40.91 96.68 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.655 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HG2' ' CE1' ' A' ' 70' ' ' TYR . 5.0 tpp180 -73.74 -40.99 63.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.428 0.156 . . . . 0.0 110.8 178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.507 HG13 HD22 ' A' ' 67' ' ' LEU . 60.7 t -56.58 -55.05 21.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.876 0.37 . . . . 0.0 110.65 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 52' ' ' ILE . 7.1 p -65.71 -27.85 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -65.27 -43.64 90.62 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.844 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.25 -42.77 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.145 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.1 mt -62.64 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.767 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -63.66 -32.43 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -173.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -72.58 -38.63 67.84 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.812 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.99 -30.8 56.1 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.93 0.395 . . . . 0.0 110.539 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 31.3 mm-40 -117.9 82.07 16.53 Favored Pre-proline 0 N--CA 1.445 -0.685 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.034 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.5 -8.72 23.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.587 2.191 . . . . 0.0 112.838 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -87.48 -5.08 58.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.136 0.493 . . . . 0.0 110.439 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -105.11 25.56 10.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.148 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -76.72 -10.72 59.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.439 0.638 . . . . 0.0 109.684 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -78.99 0.5 27.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.767 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.2 m -69.78 99.37 1.35 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.253 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 p30 -57.06 124.35 65.09 Favored Pre-proline 0 CA--C 1.517 -0.295 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 173.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.6 Cg_exo -57.63 -11.69 9.64 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.935 2.424 . . . . 0.0 112.172 177.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -84.05 -36.07 23.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.634 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -136.44 65.31 1.52 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.775 0.322 . . . . 0.0 111.536 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 34' ' ' VAL . 18.1 mt -76.49 124.52 34.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.117 0.484 . . . . 0.0 111.438 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -108.82 110.73 22.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.837 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.406 HD12 ' HB ' ' B' ' 205' ' ' VAL . 53.8 mt -82.27 110.42 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.77 0.319 . . . . 0.0 110.383 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.663 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.0 t70 -103.95 99.0 8.76 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -71.97 -8.12 52.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.169 -176.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -84.22 -34.0 23.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.868 0.366 . . . . 0.0 110.792 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 56.6 p -78.15 -31.89 49.99 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.839 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 32.5 mt -58.91 128.48 37.44 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.904 -176.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 13.8 mtmm -72.36 150.97 91.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.871 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.15 -36.75 29.57 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.363 2.042 . . . . 0.0 112.518 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -59.26 -47.27 85.97 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.488 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -63.76 -47.67 80.07 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.173 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 71.6 mt -59.35 -35.26 73.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.086 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.9 tpt180 -72.1 -46.22 57.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.083 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -66.48 -39.71 88.91 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.962 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 89.7 mt -56.96 -57.06 14.18 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.699 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.06 -42.48 76.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.244 177.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 54.1 ttp85 -64.49 -33.45 75.92 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.162 0.506 . . . . 0.0 110.57 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.431 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 71.5 t80 -80.72 -47.17 14.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.782 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.608 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.0 m -62.54 -37.97 80.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.104 0.478 . . . . 0.0 110.637 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.8 p -70.28 -36.7 74.55 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.849 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -62.66 -28.01 69.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.393 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.613 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 44.4 t -89.55 -54.24 4.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.595 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.9 mt -76.1 -35.88 59.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -171.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 54.4 mtp180 -75.73 -5.43 45.66 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.043 -177.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 49.9 tttp . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.741 175.914 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 60.4 mt . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 121.113 0.482 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.444 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 66.6 t -77.73 134.45 28.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.467 -174.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -111.23 131.76 54.87 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.58 144.63 30.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.129 0.49 . . . . 0.0 110.538 173.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 56.8 mttm . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.398 179.029 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.545 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 74.8 m . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -71.32 144.95 90.08 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.986 0.422 . . . . 0.0 110.637 176.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -61.41 124.83 15.47 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.809 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.512 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -56.64 134.82 54.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.176 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 m -95.68 176.51 6.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -51.55 -54.5 26.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -166.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -48.93 -49.8 38.44 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.264 0.554 . . . . 0.0 110.691 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.94 -46.1 90.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.455 -174.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.512 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.8 mttt -58.01 -42.14 84.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.444 177.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -62.26 -44.76 95.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.334 177.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -63.93 -38.07 89.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.373 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.654 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.62 -39.19 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.756 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.6 p -64.26 -26.24 68.41 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.515 -0.74 . . . . 0.0 110.357 175.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 70.8 mt -81.68 -44.72 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.583 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.654 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.2 p30 -62.85 -41.7 99.47 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.676 178.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 25' ' ' LEU . 94.2 mt -60.26 -41.0 85.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.003 0.43 . . . . 0.0 110.679 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -71.16 -24.18 62.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.245 -177.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 29.1 mtpp -80.31 -22.0 41.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.597 HD11 HG12 ' A' ' 71' ' ' VAL . 92.1 mt -70.27 139.0 86.94 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.489 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.592 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 74.4 Cg_endo -75.15 161.89 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.975 2.45 . . . . 0.0 111.463 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.93 -22.86 58.37 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.337 -0.847 . . . . 0.0 114.003 -170.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -64.42 -52.08 59.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.338 0.589 . . . . 0.0 110.218 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 2.6 mptp? -69.31 -23.76 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.842 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.61 -27.52 69.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.65 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.86 -33.76 84.58 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.881 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.9 tpp180 -81.07 -40.84 23.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.447 0.165 . . . . 0.0 110.812 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.551 HG13 HD22 ' A' ' 67' ' ' LEU . 60.4 t -58.03 -52.05 63.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.918 0.39 . . . . 0.0 110.774 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.96 -30.16 49.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -177.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.53 -41.99 92.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.756 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 32' ' ' ARG . 71.2 mt -64.79 -41.75 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.103 178.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 33' ' ' VAL . 60.9 mt -64.19 -61.5 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.353 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.538 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 28.5 mt-30 -63.17 -30.32 71.49 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -76.48 -36.79 57.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -80.3 -28.2 38.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.662 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 58.5 mm-40 -111.43 81.35 3.04 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.075 176.375 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.07 -15.07 47.2 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.395 2.063 . . . . 0.0 112.718 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -84.9 -3.79 58.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.146 0.498 . . . . 0.0 110.494 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.59 23.72 14.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.79 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -64.4 -26.23 68.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.206 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -95.61 41.51 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.342 -178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.538 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 68.7 m -80.24 107.16 12.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.455 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 2.9 p30 -55.84 122.78 48.73 Favored Pre-proline 0 C--O 1.228 -0.066 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.63 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -61.18 -9.03 11.39 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.127 2.551 . . . . 0.0 112.648 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.486 ' CG ' ' HG2' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -82.98 -44.36 15.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.928 179.36 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HG2' ' CG ' ' A' ' 50' ' ' ASP . 5.5 mm-40 -133.57 70.53 1.46 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.481 -177.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.4 mt -74.35 116.14 16.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 CA-C-O 121.319 0.58 . . . . 0.0 110.253 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.0 mm-40 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.59 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 47.7 mt -89.63 107.8 18.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 175.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -107.95 98.74 8.27 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.224 1.011 . . . . 0.0 110.76 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -66.78 -7.95 24.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.849 -176.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.94 -20.31 49.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -177.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.6 p -104.5 -29.58 10.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.445 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.463 HD23 ' HG3' ' A' ' 41' ' ' GLU . 36.2 mt -51.28 123.93 10.65 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.365 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 57.4 mttp -67.01 152.56 95.88 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.271 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.65 -40.81 30.93 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.444 2.096 . . . . 0.0 112.998 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 21.9 t -54.64 -50.96 66.87 Favored 'General case' 0 C--N 1.334 -0.107 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -51.05 71.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.43 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' A' ' 59' ' ' LEU . 77.0 mt -56.47 -39.74 73.71 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.168 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 22.7 tpt180 -72.51 -46.75 53.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.344 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.2 mt-10 -68.22 -39.37 82.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.754 0.311 . . . . 0.0 110.718 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.553 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.9 mt -56.88 -55.25 36.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.593 173.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -56.04 -40.27 73.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.138 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -62.24 -43.71 98.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.441 0.639 . . . . 0.0 110.041 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -74.52 -43.89 53.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.716 -174.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.597 HG12 HD11 ' A' ' 25' ' ' LEU . 15.0 m -65.16 -37.63 80.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.993 0.425 . . . . 0.0 110.71 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.405 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 36.7 p -74.43 -35.71 63.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.327 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.7 p -67.27 -19.93 65.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.428 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 18.1 t -91.28 -54.84 3.75 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.626 178.313 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.541 HD21 HD23 ' A' ' 25' ' ' LEU . 72.3 mt -78.26 -33.86 49.38 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -171.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.405 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 67.5 mtp180 -81.32 0.09 38.68 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.713 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.704 173.816 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 40.6 mt . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.002 0.429 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 40.8 t -96.89 109.69 23.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.483 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 20.9 ttmm -95.8 111.05 23.11 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -127.67 144.35 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.613 176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.412 -178.386 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.8 m . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.851 0.358 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -72.08 147.01 90.64 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -62.77 123.7 12.78 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.874 2.383 . . . . 0.0 112.012 -176.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.531 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -55.37 136.02 49.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.625 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.7 m -91.75 175.21 6.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -51.76 -57.84 8.12 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -164.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -56.44 -34.12 66.53 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -177.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.36 -45.96 71.41 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.531 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.3 mttt -60.07 -42.12 93.87 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.846 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 16' ' ' ARG . 18.4 ttp85 -62.68 -43.5 98.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.483 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -67.23 -42.08 84.63 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.821 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.34 -50.03 74.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.264 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.422 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.1 p -59.77 -33.77 72.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.211 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.2 mt -71.59 -42.22 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.757 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.546 ' HB3' HD12 ' A' ' 75' ' ' LEU . 67.7 m-20 -62.61 -44.31 96.61 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.548 0.214 . . . . 0.0 111.165 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.417 ' HA ' HD12 ' A' ' 25' ' ' LEU . 96.8 mt -61.22 -34.31 60.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 0.0 111.35 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -82.98 -24.51 32.89 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.043 0.925 . . . . 0.0 108.747 -174.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.858 ' HD2' HD13 ' A' ' 75' ' ' LEU . 19.8 ttmt -73.06 -32.33 64.97 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.786 173.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.716 HD23 HD21 ' A' ' 75' ' ' LEU . 90.0 mt -62.6 142.12 96.77 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 121.153 0.502 . . . . 0.0 111.843 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.5 Cg_endo -82.38 169.56 13.94 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 123.045 2.497 . . . . 0.0 112.874 176.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.6 -46.0 53.83 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 114.482 0.553 . . . . 0.0 114.482 -172.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.424 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 3.2 mp0 -47.27 -56.83 6.02 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.823 0.82 . . . . 0.0 110.989 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.619 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -74.4 -24.88 59.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.814 -174.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 13.9 mt -65.13 -27.41 68.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.266 177.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.24 -34.38 89.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.967 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.467 ' O ' HG13 ' A' ' 36' ' ' ILE . 19.4 tpp180 -77.7 -39.65 44.0 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 67' ' ' LEU . 87.0 t -57.64 -55.24 22.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.024 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 p -63.51 -30.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.898 0.38 . . . . 0.0 110.615 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -63.86 -42.12 97.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.749 176.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.3 mt -66.0 -44.83 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -61.67 -60.55 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.165 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.36 -35.92 74.78 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -79.24 -33.85 43.26 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.98 -26.81 36.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.503 176.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' HD23 ' A' ' 59' ' ' LEU . 61.3 mm-40 -115.72 85.33 13.96 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.762 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -63.51 -13.2 34.91 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.23 1.954 . . . . 0.0 112.424 178.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.7 m -79.85 -10.04 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.001 0.429 . . . . 0.0 110.565 176.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -108.81 29.01 7.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.119 0.485 . . . . 0.0 110.21 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -69.12 -23.75 64.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.335 -175.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -95.55 25.02 4.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.503 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 p -73.25 101.03 3.27 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.398 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 2.7 p30 -56.06 122.48 48.07 Favored Pre-proline 0 C--O 1.227 -0.131 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.452 178.071 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.3 Cg_exo -58.25 -14.37 19.56 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.936 2.424 . . . . 0.0 112.039 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.07 -37.44 29.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.699 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -136.92 59.97 1.67 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.645 0.259 . . . . 0.0 111.442 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.611 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 19.7 mt -70.16 124.02 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.026 0.441 . . . . 0.0 111.496 -175.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' CD ' ' HB2' ' B' ' 206' ' ' LYS . 44.8 mm-40 -109.84 115.25 29.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.629 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 34.5 mt -90.11 109.97 21.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 16.0 p-10 -105.98 99.01 8.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.83 0.824 . . . . 0.0 110.659 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -69.94 -0.26 7.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.699 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -87.88 -22.58 24.33 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.219 -175.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 75.4 p -102.18 -32.9 9.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.834 176.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.535 HD23 ' HG3' ' A' ' 41' ' ' GLU . 35.5 mt -48.3 123.03 5.9 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.025 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -65.26 152.04 92.68 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.792 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -48.76 -35.04 29.43 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.435 2.09 . . . . 0.0 112.321 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 t -56.37 -53.04 62.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 176.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -46.54 88.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.718 -178.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.406 HD21 ' HB2' ' A' ' 59' ' ' LEU . 81.9 mt -59.14 -36.18 74.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -76.83 -45.31 29.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.076 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -62.29 -45.51 92.92 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.527 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.4 mt -57.37 -55.41 35.18 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.109 176.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -55.45 -47.99 75.19 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.17 -40.57 81.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.883 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -74.29 -47.57 33.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.641 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.8 m -65.26 -35.34 75.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.81 0.338 . . . . 0.0 110.312 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.498 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 35.6 p -72.88 -39.69 66.21 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.647 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 91.8 p -63.9 -21.77 66.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.729 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.619 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.2 t -90.77 -48.22 7.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.798 0.332 . . . . 0.0 110.316 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.858 HD13 ' HD2' ' A' ' 24' ' ' LYS . 70.6 mt -82.37 -37.09 26.14 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -171.706 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.498 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 82.6 mtp180 -77.08 -7.41 55.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.076 0.465 . . . . 0.0 110.377 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.507 173.93 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.185 0.517 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.422 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.3 t -114.92 104.09 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.359 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.611 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.1 ttmm -90.12 109.59 20.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 171.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -124.65 137.84 54.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp . . . . . 0 C--N 1.319 -0.747 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.353 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.941 0.401 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -65.8 147.18 98.88 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.341 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -72.07 140.55 34.71 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.594 2.196 . . . . 0.0 111.252 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.497 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.63 120.2 23.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.297 -177.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.9 p -69.92 179.45 2.26 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.51 -50.81 72.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 121.273 -0.171 . . . . 0.0 110.981 -173.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -56.8 -41.76 78.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.834 0.35 . . . . 0.0 111.073 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.29 -44.96 93.53 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.731 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.9 mttt -62.7 -41.04 98.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.688 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttp85 -64.36 -43.15 95.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 110.107 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -61.24 -41.73 97.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.739 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.774 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.99 -32.6 72.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.103 -176.04 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.6 p -68.38 -26.76 65.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.624 -0.673 . . . . 0.0 109.925 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.7 mt -83.8 -39.18 20.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.691 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.774 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.5 p30 -66.17 -41.1 90.78 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.896 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.8 mt -60.94 -40.31 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 0.0 110.096 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -66.67 -29.07 68.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 48.6 mttp -66.25 -28.65 68.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.107 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.657 HD11 HG12 ' A' ' 71' ' ' VAL . 94.5 mt -76.39 135.84 68.83 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.385 -171.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.481 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 86.7 Cg_endo -81.72 171.94 12.73 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.265 2.643 . . . . 0.0 112.531 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.83 -45.11 61.32 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 114.333 0.493 . . . . 0.0 114.333 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -46.66 -52.69 13.22 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.532 0.682 . . . . 0.0 111.478 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -80.47 -29.24 37.44 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.057 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' B' ' 207' ' ' PHE . 12.9 tp -63.19 -24.28 67.81 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.825 0.345 . . . . 0.0 110.2 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.76 -37.02 94.14 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 111.807 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.481 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.7 tpp180 -75.47 -39.02 59.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.442 HG13 HD22 ' A' ' 67' ' ' LEU . 60.0 t -57.33 -55.01 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.076 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.49 -30.81 51.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.022 0.439 . . . . 0.0 110.482 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -64.29 -41.54 96.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.153 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 32' ' ' ARG . 67.7 mt -63.76 -47.35 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.396 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 33' ' ' VAL . 46.5 mt -63.95 -59.56 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.341 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.58 -31.29 70.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 t -77.99 -39.53 42.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.891 -0.324 . . . . 0.0 111.401 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.06 -28.58 57.68 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.073 0.463 . . . . 0.0 110.447 176.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -116.9 78.98 9.76 Favored Pre-proline 0 N--CA 1.44 -0.929 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.468 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.27 -15.66 49.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.18 1.92 . . . . 0.0 112.391 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.3 t -73.08 -12.72 61.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.133 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.09 23.31 14.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -65.29 -31.6 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.725 0.297 . . . . 0.0 111.262 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -85.65 41.95 0.93 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.255 0.55 . . . . 0.0 110.735 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.0 m -84.5 99.99 11.07 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -52.81 117.01 10.05 Favored Pre-proline 0 CA--C 1.523 -0.093 0 O-C-N 123.75 0.656 . . . . 0.0 110.233 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.97 -31.74 45.0 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.701 2.934 . . . . 0.0 114.222 -172.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -73.87 -27.74 61.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.2 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -141.49 79.18 1.67 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.152 0.501 . . . . 0.0 109.652 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.418 HD12 ' CE1' ' B' ' 207' ' ' PHE . 50.5 mt -89.84 126.55 42.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.501 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 33.9 mm-40 -98.78 123.34 42.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.917 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.4 mt -98.01 108.59 22.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 170.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -108.92 100.8 9.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.141 0.972 . . . . 0.0 110.587 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -70.58 -2.85 15.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.546 -1.206 . . . . 0.0 112.128 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -83.0 -23.29 33.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.0 p -97.98 -26.67 14.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.958 0.409 . . . . 0.0 110.095 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.2 mt -58.75 127.53 32.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.047 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -69.76 147.8 96.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -44.19 -34.82 7.29 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.54 2.16 . . . . 0.0 113.095 173.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.6 m -56.69 -51.71 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.145 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -63.37 -45.65 90.14 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.261 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.7 mt -59.07 -35.09 72.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.717 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -71.54 -51.54 22.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.121 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -57.49 -42.86 83.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.543 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.582 ' O ' HG13 ' A' ' 71' ' ' VAL . 78.8 mt -58.69 -58.96 6.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.6 177.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -57.21 -45.42 83.84 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.765 0.317 . . . . 0.0 111.297 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -58.54 -38.63 78.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.27 0.557 . . . . 0.0 110.612 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -75.59 -47.89 24.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.653 -177.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.676 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.5 m -62.9 -39.85 86.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.069 0.461 . . . . 0.0 110.396 -176.154 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.6 p -68.67 -30.81 69.58 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.105 -178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 85.6 p -68.96 -23.19 64.11 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.377 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.497 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 45.6 t -92.43 -44.95 8.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.121 0.486 . . . . 0.0 110.542 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.562 HD21 HD23 ' A' ' 25' ' ' LEU . 27.9 mt -83.41 -33.76 25.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.574 -171.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.3 mtp180 -78.31 -1.56 33.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.249 0.547 . . . . 0.0 110.05 176.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 tttp . . . . . 0 N--CA 1.451 -0.411 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.253 172.885 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 204' ' ' ILE . . . . . 0.419 HD12 ' N ' ' B' ' 204' ' ' ILE . 4.3 mp . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.846 0.355 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 60.4 t -104.05 109.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.136 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.501 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.1 ttmm -99.75 81.9 2.53 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.55 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.5 p90 -93.35 159.19 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.003 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.6 ' SG ' ' HB2' ' A' ' 65' ' ' ARG . 52.8 t . . . . . 0 CA--C 1.516 -0.327 0 CA-C-O 120.746 0.307 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -85.23 145.31 42.54 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.027 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -64.23 127.45 19.24 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.85 2.367 . . . . 0.0 111.69 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -61.27 128.86 38.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.226 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.6 p -75.0 176.73 6.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -48.23 80.76 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -53.31 -46.84 69.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.364 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.27 -45.23 77.26 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.864 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.9 mttt -56.46 -38.56 71.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.18 175.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -60.93 -45.31 95.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.314 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -62.95 -39.94 96.15 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.591 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.615 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -69.07 -30.64 69.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.202 -178.269 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.532 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 80.9 p -69.71 -30.03 67.56 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.431 -0.793 . . . . 0.0 110.011 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.6 mt -80.25 -39.18 29.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.608 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.615 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.3 p30 -68.0 -42.48 80.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.397 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -59.5 -39.36 79.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.558 177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -67.16 -30.86 70.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.902 0.382 . . . . 0.0 111.138 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 75' ' ' LEU . 77.4 mttt -62.54 -30.04 71.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.842 175.07 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.682 HD11 HG12 ' A' ' 71' ' ' VAL . 95.9 mt -73.36 139.28 78.44 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.381 -172.217 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.03 170.28 15.34 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.127 2.552 . . . . 0.0 112.866 177.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.79 -46.26 48.49 Favored Glycine 0 C--N 1.333 0.39 0 O-C-N 123.368 0.418 . . . . 0.0 113.649 -174.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.6 mp0 -47.03 -56.87 5.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.265 0.555 . . . . 0.0 110.988 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -27.09 61.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.52 -176.083 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.2 -25.16 67.64 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.773 0.32 . . . . 0.0 110.547 178.191 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.38 92.74 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.073 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 32' ' ' ARG . 5.4 tpp180 -76.8 -40.19 48.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.666 0.27 . . . . 0.0 110.537 177.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.451 HG13 HD22 ' A' ' 67' ' ' LEU . 58.0 t -57.75 -54.07 36.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.897 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.31 -29.84 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.573 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.87 -45.29 90.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.644 176.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.7 -47.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.845 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.6 mt -62.63 -58.99 5.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.768 -178.369 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -62.74 -30.98 71.84 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.3 t -70.39 -50.73 35.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.602 0.239 . . . . 0.0 110.895 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -69.29 -30.85 69.02 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.94 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.42 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 15.9 mm-40 -116.97 81.29 12.14 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.649 -178.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.03 -18.38 64.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.4 2.066 . . . . 0.0 113.104 -177.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.7 t -70.42 -27.79 64.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.036 0.446 . . . . 0.0 110.114 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.38 23.27 1.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.833 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -72.03 -13.0 61.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.365 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -85.14 4.8 32.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.286 0.565 . . . . 0.0 110.621 -177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.4 m -66.86 104.7 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.159 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 123.66 71.89 Favored Pre-proline 0 CA--C 1.52 -0.2 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 173.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.75 -14.28 17.12 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.001 2.468 . . . . 0.0 112.409 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.04 -33.64 22.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.928 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -137.29 68.02 1.42 Allowed 'General case' 0 C--O 1.227 -0.112 0 CA-C-O 120.713 0.292 . . . . 0.0 110.758 -178.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.442 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.9 mt -78.42 122.09 32.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.346 -175.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -102.34 122.13 43.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.558 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.0 mt -93.63 109.0 21.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -105.42 95.51 5.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.14 0.972 . . . . 0.0 110.627 176.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -66.47 -5.27 10.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.28 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -82.23 -27.97 32.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.634 0.254 . . . . 0.0 110.944 -177.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.3 p -93.05 -22.48 19.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.418 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 27.1 mt -59.9 131.8 51.99 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.078 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.42 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 11.8 mtmm -82.79 153.84 67.66 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.119 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.2 -43.94 24.83 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.446 2.097 . . . . 0.0 113.057 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 70.6 m -52.23 -52.0 54.96 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.147 0.279 . . . . 0.0 111.153 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -60.75 -45.68 93.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 64.0 mt -60.9 -36.83 80.27 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.01 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.6 ' HB2' ' SG ' ' A' ' 7' ' ' CYS . 32.1 tpt180 -70.75 -50.33 37.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 177.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 62' ' ' SER . 60.0 mm-40 -59.05 -41.05 86.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.905 0.383 . . . . 0.0 110.225 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 71' ' ' VAL . 80.1 mt -61.91 -58.16 9.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.692 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.48 -45.23 73.16 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.056 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.86 -36.23 80.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.924 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 69.6 t80 -75.78 -49.11 19.06 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.549 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.682 HG12 HD11 ' A' ' 25' ' ' LEU . 13.7 m -62.65 -40.36 88.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.122 0.486 . . . . 0.0 110.537 -175.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.415 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 29.1 p -65.63 -35.14 79.92 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.082 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.9 p -66.0 -24.77 66.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 110.624 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 44.0 t -91.33 -41.99 10.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.743 0.306 . . . . 0.0 110.579 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.546 HD21 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.7 -38.36 13.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -168.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 39.6 mtp180 -73.28 -4.71 34.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.853 0.835 . . . . 0.0 109.227 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.0 tttt . . . . . 0 N--CA 1.448 -0.555 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.132 170.952 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 CA--C 1.522 -0.129 0 CA-C-O 121.794 0.807 . . . . 0.0 111.401 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.532 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 57.7 t -87.8 113.47 25.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.103 -176.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 19.7 ttmm -96.51 113.77 25.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.73 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -125.38 139.73 53.41 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.351 0.596 . . . . 0.0 110.6 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 62.7 mttm . . . . . 0 C--N 1.32 -0.699 0 CA-C-N 115.316 -0.856 . . . . 0.0 108.696 175.017 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.478 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 55.7 m . . . . . 0 N--CA 1.444 -0.729 0 CA-C-O 121.225 0.536 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -87.4 143.91 34.98 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.785 177.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.08 123.31 12.64 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.795 2.33 . . . . 0.0 111.433 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.4 mmt -62.81 130.12 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.634 -176.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.0 m -90.14 177.68 6.37 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -57.64 -54.11 50.58 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -165.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -48.99 -41.26 33.76 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.41 -48.39 70.2 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.694 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 10' ' ' MET . 95.0 mttt -57.58 -40.73 79.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.279 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -63.78 -47.07 82.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.335 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -60.33 -46.11 91.05 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.19 -48.21 82.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.471 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.589 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.7 p -60.81 -32.99 72.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.144 0.497 . . . . 0.0 110.753 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -76.68 -34.93 58.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.547 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.468 ' HB3' HD12 ' A' ' 75' ' ' LEU . 64.0 m-20 -68.91 -41.93 77.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.228 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.16 -35.22 60.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.948 0.404 . . . . 0.0 110.664 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -73.95 -24.88 59.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.764 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.6 mttp -66.33 -42.84 87.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.295 0.569 . . . . 0.0 110.363 172.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD11 HG12 ' A' ' 71' ' ' VAL . 96.1 mt -58.41 136.04 85.45 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.651 -174.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.1 Cg_endo -80.3 172.43 13.7 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.381 2.72 . . . . 0.0 112.88 177.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.46 -46.3 52.86 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 123.328 0.393 . . . . 0.0 114.034 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -48.71 -58.21 5.11 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.208 0.528 . . . . 0.0 111.843 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.575 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.3 mptp? -71.22 -23.91 62.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.964 -175.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -63.63 -26.72 68.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.336 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.63 89.87 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.026 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.405 ' O ' HG13 ' A' ' 36' ' ' ILE . 22.6 tpp180 -78.76 -41.0 31.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.538 0.209 . . . . 0.0 110.578 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 HD22 ' A' ' 67' ' ' LEU . 95.6 t -55.97 -55.53 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.004 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.97 -31.8 53.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.604 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -64.95 -41.09 95.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.884 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.7 mt -64.95 -44.93 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.177 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -62.25 -61.64 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.972 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -61.78 -31.83 72.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -173.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -79.81 -30.93 40.65 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.698 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -83.96 -25.32 30.16 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.227 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.06 81.68 16.6 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.508 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.89 -16.18 53.33 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.694 2.263 . . . . 0.0 113.116 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 m -78.48 -8.4 58.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.013 0.435 . . . . 0.0 110.317 176.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.6 mt -110.07 28.81 8.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.228 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -81.81 -8.33 59.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.469 0.652 . . . . 0.0 110.514 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -103.4 30.46 4.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.708 176.04 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.0 m -72.48 110.88 7.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.578 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.79 118.6 13.73 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 123.204 0.315 . . . . 0.0 110.202 175.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.99 -13.03 32.61 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.705 2.27 . . . . 0.0 111.109 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 4.3 m-20 -78.29 -37.46 44.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.16 -178.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.11 60.94 1.36 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.502 0.191 . . . . 0.0 110.993 -176.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 16.2 mt -63.21 123.48 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.039 0.447 . . . . 0.0 111.898 -173.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' B' ' 206' ' ' LYS . 41.0 mm-40 -100.7 116.96 33.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.432 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.6 mt -95.35 107.25 19.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 174.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -107.48 98.38 8.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.907 0.861 . . . . 0.0 110.273 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -68.59 -6.07 23.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.867 -1.061 . . . . 0.0 112.162 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -76.8 -31.11 56.75 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.77 0.319 . . . . 0.0 110.84 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 p -93.32 -22.82 18.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.43 131.56 50.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.11 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -74.29 152.8 88.11 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.079 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -49.27 -34.88 32.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.599 2.199 . . . . 0.0 111.939 174.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.5 m -56.79 -52.4 65.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.252 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.18 -47.86 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.616 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.02 -35.3 69.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.15 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.478 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 27.9 tpt180 -73.35 -49.97 24.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.779 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -63.63 -41.51 98.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.782 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.58 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.3 mt -58.33 -55.87 29.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.334 176.162 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -55.81 -47.75 76.62 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.882 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -57.65 -38.15 74.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.097 0.475 . . . . 0.0 110.873 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -75.61 -49.28 18.96 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.589 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.58 HG13 ' O ' ' A' ' 67' ' ' LEU . 6.3 m -63.91 -39.85 86.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.763 0.316 . . . . 0.0 110.27 -175.424 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.6 p -67.04 -35.64 80.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.11 -178.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -67.91 -24.51 65.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.866 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.487 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.1 t -91.96 -26.26 18.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.05 0.452 . . . . 0.0 110.814 -178.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 HD23 ' A' ' 25' ' ' LEU . 31.1 mt -103.45 -44.99 4.98 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -171.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -69.88 -16.09 63.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.0 tttt . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.043 176.805 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 32.4 mm . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.589 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.4 t -109.64 129.74 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.253 -173.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 53' ' ' GLU . 37.6 ttmt -118.25 117.66 29.72 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.403 ' CE2' HD11 ' A' ' 54' ' ' ILE . 23.2 p90 -133.42 145.08 49.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.252 0.549 . . . . 0.0 111.274 -178.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 55.9 mttp . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.294 173.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 85.3 m . . . . . 0 C--O 1.234 0.271 0 CA-C-O 120.798 0.332 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.03 148.34 47.66 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.093 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.18 129.8 28.35 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.0 2.467 . . . . 0.0 112.399 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.45 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -66.31 132.7 48.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.48 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 p -75.44 177.04 6.96 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.3 -47.81 84.45 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.285 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.68 -47.05 70.8 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.345 0.593 . . . . 0.0 109.874 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.26 -46.86 84.88 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.652 -176.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.2 mttt -58.19 -40.01 80.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.154 176.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -63.25 -42.94 99.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.547 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -64.37 -36.06 82.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.943 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.735 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.42 -31.8 69.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.735 178.818 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.529 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 60.4 p -70.0 -25.32 63.55 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.569 -0.707 . . . . 0.0 110.001 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.3 -39.27 17.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.334 -178.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.735 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -67.61 -41.27 84.27 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.804 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -60.17 -38.6 77.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.171 0.51 . . . . 0.0 110.15 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -68.35 -31.15 70.34 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.753 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 47.6 mttp -63.39 -38.87 92.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.024 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.631 HD11 HG12 ' A' ' 71' ' ' VAL . 94.3 mt -64.38 135.17 96.24 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.681 -173.043 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -80.36 172.78 13.21 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.533 2.822 . . . . 0.0 113.012 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.8 -46.93 48.18 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.275 0.47 . . . . 0.0 114.275 -172.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.56 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.1 mp0 -48.74 -52.6 22.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.683 0.754 . . . . 0.0 111.335 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.547 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.5 mptp? -76.4 -24.36 54.07 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.193 -173.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.87 -29.19 68.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.046 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.04 -43.72 99.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.783 176.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.592 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.6 tpm_? -68.47 -42.11 79.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.686 0.279 . . . . 0.0 110.66 177.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.597 HG13 HD22 ' A' ' 67' ' ' LEU . 88.3 t -58.17 -58.03 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.927 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 p -62.45 -29.53 47.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.514 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 66.3 t-80 -69.63 -41.82 75.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.323 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.592 HG13 ' HE ' ' A' ' 32' ' ' ARG . 64.4 mt -61.69 -41.83 91.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 175.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.479 HG23 HD21 ' A' ' 59' ' ' LEU . 72.7 mt -62.7 -60.45 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.002 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -174.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -72.53 -42.89 64.24 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.988 -178.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.27 -35.81 71.5 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.557 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.517 ' HG3' HD23 ' A' ' 59' ' ' LEU . 55.6 mm-40 -114.73 86.14 12.53 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.776 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -64.25 -16.26 54.07 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.233 1.956 . . . . 0.0 112.365 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 m -77.36 -12.27 59.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.923 0.392 . . . . 0.0 110.711 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 61.4 mt -99.99 26.44 6.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.123 0.487 . . . . 0.0 110.498 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -70.52 -15.11 62.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.437 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -81.06 11.82 3.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 m -72.57 94.37 1.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.401 176.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.3 119.36 55.56 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -49.84 -31.33 26.08 Favored 'Trans proline' 0 N--CA 1.476 0.452 0 C-N-CA 123.872 3.048 . . . . 0.0 114.651 -174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -74.61 -28.99 61.13 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.134 -0.227 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -140.3 72.95 1.41 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -175.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 26.8 mt -87.3 126.1 41.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.798 0.332 . . . . 0.0 111.377 -176.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.421 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.8 mm-40 -103.43 116.22 32.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.897 178.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.458 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.0 mt -88.99 108.36 18.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -107.88 100.2 9.59 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 122.135 0.969 . . . . 0.0 110.466 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -67.22 -10.12 47.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.235 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -77.15 -30.21 54.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.098 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.4 p -89.31 -26.58 21.04 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 109.922 177.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 41' ' ' GLU . 39.7 mt -59.0 126.97 29.91 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.822 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.413 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 20.4 mtmm -68.6 151.11 97.43 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.94 -34.76 17.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.522 2.148 . . . . 0.0 112.436 174.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -55.92 -56.21 23.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.495 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -58.87 -46.29 88.14 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.677 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.5 mt -58.57 -35.76 72.89 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.974 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.465 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 31.0 tpt180 -76.39 -47.39 23.42 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.001 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -60.33 -42.65 96.11 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.771 0.32 . . . . 0.0 110.42 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.597 HD22 HG13 ' A' ' 33' ' ' VAL . 80.2 mt -59.49 -58.27 9.36 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.482 175.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -54.38 -47.15 73.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -58.03 -37.45 74.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.206 0.527 . . . . 0.0 110.56 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' SER . 62.8 t80 -74.77 -47.53 30.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.764 -179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.645 HG21 ' CG ' ' A' ' 21' ' ' ASP . 10.7 m -63.42 -40.96 90.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.002 0.43 . . . . 0.0 110.347 -176.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.48 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.3 p -67.59 -31.0 70.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.331 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 70' ' ' TYR . 45.2 t -59.96 -33.66 72.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.397 175.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.498 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.5 t -91.56 -36.13 13.87 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.736 0.303 . . . . 0.0 111.025 -175.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.519 HD21 HD23 ' A' ' 25' ' ' LEU . 21.0 mt -94.17 -29.43 15.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -170.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 72' ' ' THR . 72.2 mtp180 -76.23 -16.42 59.82 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.8 tttp . . . . . 0 N--CA 1.45 -0.427 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.133 171.897 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 50.4 mt . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 48.7 t -87.69 104.87 14.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.313 -175.027 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 3.9 ttmp? -91.73 103.98 16.49 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.473 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -116.65 151.57 36.02 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.383 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp . . . . . 0 C--N 1.319 -0.747 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.174 -178.24 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -83.95 134.08 44.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 121.728 0.775 . . . . 0.0 112.429 -173.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -53.91 129.55 34.76 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 124.069 3.179 . . . . 0.0 112.197 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.5 mmt -66.24 149.19 50.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.725 -175.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 19.1 p -86.06 172.74 10.38 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 171.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.28 -46.29 90.35 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 118.704 0.684 . . . . 0.0 109.314 -178.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -53.67 -48.13 69.76 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.177 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.43 -44.89 92.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.95 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 11' ' ' SER . 45.3 mttp -59.58 -38.81 82.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.651 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.3 ttp-105 -60.07 -42.14 93.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.074 0.464 . . . . 0.0 109.947 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -63.79 -39.21 93.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.468 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.812 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.62 -39.59 73.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.549 -178.533 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.455 ' HB2' HG21 ' B' ' 205' ' ' VAL . 85.7 p -61.45 -29.74 70.14 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.531 -0.731 . . . . 0.0 110.233 174.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 58.6 mt -78.58 -43.22 27.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.637 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.812 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.8 p30 -63.12 -41.32 99.3 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.682 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.9 mt -59.31 -41.05 82.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.68 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.09 -21.0 61.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.649 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.5 mtpp -84.94 -13.4 50.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.06 0.457 . . . . 0.0 110.248 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.533 HD23 HD21 ' A' ' 75' ' ' LEU . 96.1 mt -81.73 136.73 47.88 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.978 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.0 Cg_endo -79.25 171.92 15.45 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.278 2.652 . . . . 0.0 112.941 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.86 -44.59 61.33 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 121.456 -0.402 . . . . 0.0 113.694 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -48.52 -52.75 21.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 122.857 0.463 . . . . 0.0 110.809 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -76.46 -28.18 56.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.234 -177.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' HG12 ' A' ' 34' ' ' VAL . 10.8 mt -60.06 -30.25 69.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.877 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.25 -39.81 96.52 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.822 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 36' ' ' ILE . 24.0 tpp180 -72.61 -42.92 63.97 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 177.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.9 t -57.11 -54.78 25.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.836 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 30' ' ' LEU . 12.0 p -65.72 -29.03 45.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.803 -178.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.84 -42.96 94.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.6 mt -64.6 -43.18 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.263 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' VAL . 49.3 mt -63.22 -62.58 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 22.1 mt-30 -60.83 -36.72 79.82 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -68.86 -46.57 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.423 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.38 -35.23 77.39 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.823 0.344 . . . . 0.0 110.663 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 29.3 mm-40 -114.17 85.04 9.8 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.909 -174.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.35 -13.64 40.87 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.225 1.95 . . . . 0.0 111.789 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -79.2 -5.47 54.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 177.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 51.9 mt -108.91 33.18 4.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.237 0.542 . . . . 0.0 109.739 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -68.19 -17.84 64.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.425 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.44 41.85 1.01 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.203 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.8 m -98.67 88.1 3.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.119 0.485 . . . . 0.0 110.644 178.067 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 61.7 m-80 -68.87 124.33 90.02 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.802 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 53.8 Cg_exo -55.43 -21.68 31.09 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.429 2.752 . . . . 0.0 114.275 -174.233 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -72.62 -35.33 67.8 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -144.88 76.56 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.168 -175.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.0 mt -76.02 127.11 37.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.021 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -100.94 129.11 46.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.63 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 32.9 mt -110.23 108.43 25.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.05 102.65 11.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.046 0.927 . . . . 0.0 110.298 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.9 -13.65 61.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.547 -1.206 . . . . 0.0 112.628 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -77.58 -25.58 50.09 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.238 -177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.5 p -91.49 -23.98 19.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 22.9 mt -59.5 130.2 45.71 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.63 176.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 19.8 mttm -73.24 148.49 88.65 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.541 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.41 -34.1 24.62 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.271 1.981 . . . . 0.0 112.248 174.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.3 t -57.12 -55.16 38.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.245 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -60.32 -47.7 84.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.777 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 mt -60.34 -37.08 79.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.117 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.43 -48.02 65.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.572 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -64.16 -44.65 91.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.519 HD22 HG13 ' A' ' 33' ' ' VAL . 94.1 mt -58.43 -56.08 26.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.352 177.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.48 -43.79 75.87 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.087 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -61.0 -41.91 97.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 0.0 111.043 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -71.82 -47.36 53.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.714 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.548 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.5 m -63.75 -38.72 83.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.158 0.504 . . . . 0.0 110.976 -175.291 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 34.3 p -73.6 -31.61 63.66 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HD2' ' A' ' 77' ' ' LYS . 31.5 t -69.92 -19.41 63.39 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.256 177.112 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.591 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 38.4 t -90.46 -55.71 3.48 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.39 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.533 HD21 HD23 ' A' ' 25' ' ' LEU . 76.4 mt -77.68 -36.07 51.61 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 39.8 mtp180 -82.06 -6.37 59.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.807 -176.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.488 ' HD2' ' O ' ' A' ' 73' ' ' SER . 54.6 mttm . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.204 173.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 34.0 mt . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 19' ' ' SER . 60.6 t -85.23 137.01 21.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.406 -173.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.7 mptp? -119.17 132.75 56.0 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -138.89 145.14 39.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.911 0.386 . . . . 0.0 110.236 174.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 62.8 mttm . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.275 178.251 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.4 m . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.839 0.352 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -68.95 143.05 94.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.099 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.66 132.39 40.08 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.855 2.37 . . . . 0.0 111.27 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.513 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -65.61 126.52 28.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.267 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 p -72.81 175.13 6.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.67 -49.98 75.63 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.655 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -55.59 -41.95 74.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.197 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.57 -45.79 85.51 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.925 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.513 ' HE3' ' O ' ' A' ' 10' ' ' MET . 92.0 mttt -59.94 -42.24 93.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -63.52 -40.29 96.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.376 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -61.33 -41.05 96.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.719 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.87 -33.43 73.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -179.613 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.492 ' HB2' HG22 ' B' ' 205' ' ' VAL . 80.1 p -68.56 -25.97 65.17 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.509 -0.744 . . . . 0.0 110.016 174.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -86.33 -38.15 17.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.416 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.719 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -68.17 -41.15 81.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.667 176.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.59 -37.8 76.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.077 0.465 . . . . 0.0 110.364 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.32 -33.09 73.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.926 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.1 mttp -62.56 -40.06 95.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.333 0.587 . . . . 0.0 110.469 174.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.623 HD23 HD21 ' A' ' 75' ' ' LEU . 91.4 mt -63.97 133.12 95.48 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.117 -175.083 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.526 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 85.3 Cg_endo -81.25 171.47 13.8 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.185 2.59 . . . . 0.0 112.951 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.6 -43.58 46.05 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 114.443 0.537 . . . . 0.0 114.443 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.569 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 1.3 mp0 -51.76 -57.19 9.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.625 0.726 . . . . 0.0 110.797 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -71.68 -25.33 62.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.726 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 30' ' ' LEU . 14.7 mt -64.29 -24.05 67.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.009 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.94 -33.79 88.14 Favored Glycine 0 C--N 1.335 0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.103 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -79.17 -38.85 34.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.697 0.284 . . . . 0.0 110.356 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.482 HG13 HD22 ' A' ' 67' ' ' LEU . 60.3 t -59.29 -53.27 50.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.778 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 p -60.51 -33.45 54.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.993 0.425 . . . . 0.0 110.559 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -65.3 -44.44 87.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.173 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -63.47 -46.27 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.469 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.2 mt -60.33 -65.71 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.892 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.471 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 0.0 OUTLIER -58.35 -33.33 69.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -176.589 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 41.1 t -74.27 -27.72 60.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.729 0.299 . . . . 0.0 111.092 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -89.2 -27.37 20.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.063 0.459 . . . . 0.0 110.472 174.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -119.93 87.05 37.67 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.802 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -66.67 -10.64 28.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.167 1.911 . . . . 0.0 111.869 173.85 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.2 m -85.84 4.44 37.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.8 mt -117.09 47.57 1.47 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 110.588 177.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -90.75 -4.11 56.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.465 0.65 . . . . 0.0 110.037 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -77.66 -13.75 59.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.188 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.471 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.5 m -77.88 86.79 4.1 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.526 176.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -71.24 129.61 88.89 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-N 115.122 -0.944 . . . . 0.0 108.945 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.503 ' HA ' HD11 ' A' ' 52' ' ' ILE . 59.5 Cg_exo -47.58 -25.51 5.46 Favored 'Trans proline' 0 N--CA 1.479 0.675 0 C-N-CA 124.204 3.27 . . . . 0.0 115.083 -174.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -81.69 -23.26 36.95 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.443 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -144.65 77.89 1.55 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.142 0.496 . . . . 0.0 110.173 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.503 HD11 ' HA ' ' A' ' 49' ' ' PRO . 38.9 mt -91.01 129.4 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.437 -175.002 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.577 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 28.0 mm-40 -103.63 138.53 40.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.468 174.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.2 mt -112.81 108.89 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -111.94 99.0 7.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.06 0.933 . . . . 0.0 110.292 174.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -66.19 -12.64 57.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.129 -174.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.82 -26.97 60.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.913 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.3 p -93.38 -26.32 17.31 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.47 132.4 53.87 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.132 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mtmm -81.12 149.75 66.9 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.444 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.82 -41.59 11.82 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.956 2.438 . . . . 0.0 112.867 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -53.05 -54.08 40.7 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.716 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.5 m -61.31 -48.11 82.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.832 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.6 mt -58.01 -35.42 71.23 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.14 0.495 . . . . 0.0 110.976 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.64 -46.09 48.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.783 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -64.78 -42.88 94.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.644 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 71' ' ' VAL . 87.7 mt -57.38 -56.74 17.96 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.568 177.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -55.4 -44.27 76.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.37 -37.77 78.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 110.912 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -78.39 -47.32 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.016 -177.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.61 HG12 HD11 ' A' ' 25' ' ' LEU . 15.4 m -61.46 -41.82 91.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.139 0.495 . . . . 0.0 110.399 -176.003 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 24.9 p -65.66 -35.72 81.59 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.932 -178.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.9 p -68.49 -23.24 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.853 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.4 t -91.4 -29.54 17.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.87 0.367 . . . . 0.0 110.704 -179.072 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.623 HD21 HD23 ' A' ' 25' ' ' LEU . 34.8 mt -101.64 -37.1 8.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -80.89 -3.21 50.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.264 0.554 . . . . 0.0 110.633 -177.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.076 170.863 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 45.8 mm . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.971 0.415 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 3.5 t -95.69 147.74 5.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.002 -177.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.577 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.8 ttmm -139.09 112.77 8.38 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.48 ' CE1' HD12 ' A' ' 52' ' ' ILE . 30.0 p90 -132.51 136.14 46.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.367 0.603 . . . . 0.0 111.017 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.346 179.766 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.57 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 77.2 m . . . . . 0 C--O 1.235 0.311 0 CA-C-O 121.107 0.479 . . . . 0.0 111.694 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -68.83 144.43 95.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.212 173.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.4 130.6 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.841 2.361 . . . . 0.0 111.746 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.589 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 25.8 mmt -65.88 135.39 54.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.878 -175.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 p -84.14 178.33 7.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.883 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.02 -50.02 75.68 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 117.672 0.215 . . . . 0.0 110.646 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -53.95 -41.66 68.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.231 0.539 . . . . 0.0 111.102 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.16 -46.86 69.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.589 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.9 mttt -60.46 -36.99 79.57 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.402 177.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -65.05 -41.82 94.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.683 0.278 . . . . 0.0 110.307 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.97 -42.88 99.16 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.97 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.736 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -67.92 -32.13 72.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.289 -177.832 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB2' HG22 ' B' ' 205' ' ' VAL . 83.1 p -69.53 -26.86 64.72 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 173.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 82.8 mt -82.93 -46.14 13.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.057 -178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.736 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -60.46 -41.86 94.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.848 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HA ' HD12 ' A' ' 25' ' ' LEU . 34.8 mt -61.34 -42.02 92.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.815 0.341 . . . . 0.0 110.682 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -70.19 -25.87 63.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 0.0 111.212 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 52.1 mtpt -78.92 -19.62 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.993 0.425 . . . . 0.0 110.59 178.013 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.608 HD23 HD21 ' A' ' 75' ' ' LEU . 93.9 mt -75.0 138.64 72.74 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.238 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 97.4 Cg_endo -79.93 172.03 14.58 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 123.238 2.625 . . . . 0.0 112.954 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.2 -44.44 57.51 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.381 -0.438 . . . . 0.0 113.427 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -47.8 -54.27 12.89 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.325 0.583 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.658 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -79.87 -31.89 40.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.996 -175.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 6.2 mt -61.81 -27.16 68.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.595 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.13 -35.91 79.54 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.867 173.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' O ' HG13 ' A' ' 36' ' ' ILE . 18.8 tpp180 -79.24 -44.31 22.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.478 0.18 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.548 HG13 HD22 ' A' ' 67' ' ' LEU . 42.8 t -55.16 -52.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.659 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.28 -31.63 53.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.79 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.0 t60 -69.57 -41.13 76.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.96 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.711 HD13 ' HG3' ' A' ' 66' ' ' GLU . 55.6 mt -64.67 -43.0 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.139 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 33' ' ' VAL . 52.3 mt -62.56 -59.25 4.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.476 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.533 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 31.3 mt-30 -61.69 -31.81 71.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 t -77.02 -47.81 19.64 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.162 -0.336 . . . . 0.0 111.183 -177.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -67.64 -29.99 69.45 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.97 0.414 . . . . 0.0 110.279 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.448 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 33.8 mm-40 -113.32 83.41 6.6 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.096 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -65.52 -15.85 51.38 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.024 1.816 . . . . 0.0 111.287 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.2 m -73.25 -13.87 61.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.55 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 64.0 mt -110.21 27.0 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.097 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -62.1 -32.69 73.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.254 -176.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -88.9 42.88 1.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.153 0.501 . . . . 0.0 110.804 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.533 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.2 m -76.04 92.1 3.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.979 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 27.6 m-80 -52.54 116.99 9.73 Favored Pre-proline 0 CA--C 1.519 -0.223 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.704 177.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.2 Cg_exo -54.85 -30.35 67.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.113 2.542 . . . . 0.0 113.422 -173.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -76.69 -24.15 53.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.143 -178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -140.28 72.95 1.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.2 mt -87.81 125.73 41.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.936 0.398 . . . . 0.0 111.198 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -106.4 117.53 34.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.43 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 59.4 mt -93.83 109.12 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 173.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -110.64 100.66 9.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.937 0.875 . . . . 0.0 110.629 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -66.98 -6.89 18.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.505 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -81.71 -27.89 33.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.718 0.294 . . . . 0.0 111.209 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.4 -24.38 18.09 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.448 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 36.9 mt -61.04 123.27 17.15 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.618 176.412 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.8 mptt -69.92 148.21 96.22 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.653 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -44.75 -33.59 7.29 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.507 2.138 . . . . 0.0 113.257 175.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.2 t -60.84 -46.7 89.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.496 0.189 . . . . 0.0 110.726 178.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.5 m -65.38 -48.11 74.02 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.76 -37.85 74.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.832 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.57 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 8.7 tpt180 -71.5 -49.48 40.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.828 178.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.711 ' HG3' HD13 ' A' ' 36' ' ' ILE . 6.8 tp10 -56.28 -48.43 76.63 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.175 0.512 . . . . 0.0 110.164 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 96.1 mt -57.14 -58.24 9.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.312 178.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' VAL . 28.8 tt0 -55.04 -47.85 74.23 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.947 0.403 . . . . 0.0 111.004 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -58.04 -36.34 72.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.63 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -80.06 -46.07 17.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.835 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.576 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.0 m -64.1 -39.41 85.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.14 0.495 . . . . 0.0 110.636 -175.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.583 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 23.9 p -72.14 -34.0 68.2 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.532 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.5 p -67.98 -17.71 64.52 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.204 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.658 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.7 t -91.41 -54.26 3.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.663 177.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.608 HD21 HD23 ' A' ' 25' ' ' LEU . 65.7 mt -77.03 -30.34 55.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -173.19 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.583 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.8 mtp180 -82.09 -5.12 58.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.148 0.499 . . . . 0.0 110.297 177.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 C--N 1.324 -0.513 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.367 174.464 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 pt . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.956 0.408 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 205' ' ' VAL . . . . . 0.456 HG22 ' HB2' ' A' ' 19' ' ' SER . 12.5 t -95.73 117.19 39.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.174 -177.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 26.9 mttm -106.26 89.02 2.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -101.0 137.29 39.56 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.459 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 92.4 mttt . . . . . 0 C--N 1.317 -0.83 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.039 -177.602 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.1 m . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 120.829 0.347 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -69.75 146.67 95.87 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.84 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.01 126.24 19.78 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.865 2.377 . . . . 0.0 112.173 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' MET . . . . . 0.412 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 24.6 mmt -57.08 134.77 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.703 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 m -88.67 174.77 7.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.51 -54.92 40.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -165.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -51.65 -40.06 59.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.657 0.265 . . . . 0.0 111.695 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.66 -47.33 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.491 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.5 mttt -58.52 -41.96 86.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.943 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.44 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 ttp180 -63.48 -46.63 85.29 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.334 177.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -50.92 71.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.412 178.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 95.7 p -58.74 -37.02 75.29 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.975 0.417 . . . . 0.0 110.866 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 98.1 mt -70.3 -40.52 74.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.653 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.546 ' O ' HD11 ' A' ' 75' ' ' LEU . 63.7 m-20 -67.25 -37.2 83.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.28 -40.11 86.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.898 0.38 . . . . 0.0 110.719 176.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -72.23 -28.96 63.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.098 0.475 . . . . 0.0 110.563 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.653 ' HD3' HD13 ' A' ' 75' ' ' LEU . 46.6 mttp -62.13 -39.0 91.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.692 171.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD23 HD21 ' A' ' 75' ' ' LEU . 96.0 mt -64.47 141.43 98.21 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.787 -175.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.4 Cg_endo -82.77 172.08 11.41 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.479 2.786 . . . . 0.0 112.717 178.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.11 -39.41 63.57 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.886 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 6.5 mp0 -48.34 -59.53 3.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.73 0.776 . . . . 0.0 111.171 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.7 mptp? -77.42 -29.32 52.92 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.022 -176.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.6 -29.85 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.801 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.8 -35.06 80.45 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.84 175.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -80.69 -38.92 28.09 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 122.749 -0.266 . . . . 0.0 110.748 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.441 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -55.34 -53.76 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 110.548 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.5 p -63.78 -30.92 51.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.672 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -66.59 -41.26 88.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.101 177.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 66.0 mt -63.08 -43.17 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.048 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.462 HD13 HG23 ' A' ' 54' ' ' ILE . 47.4 mt -64.39 -62.29 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.937 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -60.67 -35.43 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.2 t -74.02 -36.81 64.47 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.264 -176.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 11.0 mpt_? -77.73 -31.84 52.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.271 176.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.439 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 21.0 mm-40 -117.91 86.37 25.04 Favored Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.473 -176.128 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.26 -9.72 24.79 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.299 1.999 . . . . 0.0 112.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.4 m -84.47 -3.87 58.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 110.393 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.8 mt -114.29 29.29 8.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.522 0.677 . . . . 0.0 109.325 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -82.19 -9.96 59.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 -172.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -100.6 24.12 9.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.379 0.609 . . . . 0.0 110.355 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.6 p -77.87 103.35 7.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.337 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -57.61 119.72 35.28 Favored Pre-proline 0 CA--C 1.52 -0.192 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.804 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HA ' HD11 ' A' ' 52' ' ' ILE . 86.4 Cg_exo -51.59 -25.31 19.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 123.546 2.83 . . . . 0.0 113.832 -176.572 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.595 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 18.5 m-20 -77.67 -28.33 51.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.433 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -143.03 76.64 1.54 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 49' ' ' PRO . 41.9 mt -87.97 129.51 39.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.069 -176.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.421 ' HG3' ' HD3' ' B' ' 206' ' ' LYS . 2.2 mp0 -108.44 123.93 49.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.214 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ILE . . . . . 0.462 HG23 HD13 ' A' ' 37' ' ' ILE . 17.9 mt -95.74 108.67 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 175.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 13.0 p-10 -104.06 97.65 7.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.008 0.908 . . . . 0.0 110.852 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -71.57 -0.42 10.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.983 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -84.93 -22.13 29.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.84 0.352 . . . . 0.0 110.582 -178.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.7 p -102.52 -25.02 13.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.978 0.418 . . . . 0.0 110.078 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 37.7 mt -57.06 131.83 51.08 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.784 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -75.89 150.55 83.79 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.32 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -45.8 -41.63 19.82 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 113.31 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.8 p -57.72 -48.11 80.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -62.82 -47.51 83.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.157 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.445 HD21 ' HB2' ' A' ' 59' ' ' LEU . 83.0 mt -57.96 -40.59 80.93 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.987 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -68.36 -46.52 69.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.271 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -68.13 -39.71 82.67 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.065 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 71' ' ' VAL . 82.3 mt -57.04 -54.16 49.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 174.676 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -57.46 -47.72 81.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.514 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -63.76 -27.78 69.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.159 -176.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -79.43 -51.67 9.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.11 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.614 HG13 ' O ' ' A' ' 67' ' ' LEU . 5.3 m -66.79 -36.24 76.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.712 0.291 . . . . 0.0 110.878 -173.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.1 p -72.37 -38.28 68.57 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.638 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.1 p -62.18 -24.19 67.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.443 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 27.7 t -91.03 -49.95 6.13 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.507 -179.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.653 HD13 ' HD3' ' A' ' 24' ' ' LYS . 71.9 mt -83.23 -21.19 33.47 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -172.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 72' ' ' THR . 35.2 mtp180 -85.96 0.54 52.98 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.412 0.625 . . . . 0.0 109.789 175.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.9 tttm . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.673 169.437 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--O 1.233 0.205 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.6 t -91.74 109.75 21.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.885 0.374 . . . . 0.0 110.657 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 206' ' ' LYS . . . . . 0.421 ' HD3' ' HG3' ' A' ' 53' ' ' GLU . 8.3 tppt? -99.18 83.56 2.88 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 175.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -99.09 158.29 15.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.116 0.484 . . . . 0.0 110.637 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 208' ' ' LYS . . . . . 0.595 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 44.4 tttp . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.233 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 120.762 0.315 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -99.28 -44.23 6.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.25 0.548 . . . . 0.0 110.942 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.48 -55.67 30.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.101 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.31 -21.66 60.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.206 0.527 . . . . 0.0 110.703 -175.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -75.53 -25.61 57.34 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.774 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -95.57 -43.19 8.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.339 177.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.3 m -105.42 101.01 10.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.358 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -75.77 147.09 80.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.653 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.5 146.8 96.71 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.4 2.734 . . . . 0.0 112.906 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.72 129.08 34.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.879 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.0 p -72.55 177.45 4.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 177.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 202' ' ' SER . 2.4 t80 -60.7 -46.74 89.22 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.014 -177.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -54.19 -44.26 71.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.015 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -61.39 -46.77 88.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.464 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.425 ' HE3' ' O ' ' A' ' 10' ' ' MET . 90.7 mttt -62.41 -34.21 76.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.549 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.9 ttp85 -68.42 -40.96 81.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.973 0.416 . . . . 0.0 110.08 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.44 -49.08 79.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.022 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.773 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -63.19 -34.83 78.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.214 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.3 t -63.91 -34.18 77.38 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.048 0.452 . . . . 0.0 110.449 173.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.9 mt -79.26 -41.47 28.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.438 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.773 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.9 p30 -65.77 -42.91 90.24 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.143 178.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.1 mt -59.33 -37.32 68.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 177.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -71.34 -23.92 62.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.626 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 51.2 mtpt -83.45 -14.25 52.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.054 0.454 . . . . 0.0 110.281 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG12 ' A' ' 71' ' ' VAL . 92.2 mt -79.76 137.73 54.37 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 95.1 Cg_endo -80.98 172.55 12.92 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 123.183 2.589 . . . . 0.0 113.156 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.84 -44.64 49.34 Favored Glycine 0 CA--C 1.519 0.321 0 O-C-N 123.361 0.413 . . . . 0.0 113.701 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 15.6 mp0 -50.16 -57.84 6.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.394 0.616 . . . . 0.0 111.175 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -74.17 -25.53 59.77 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.182 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.55 -26.89 68.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.124 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.424 ' HA2' ' HD2' ' B' ' 209' ' ' LYS . . . -63.66 -36.44 93.34 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.208 175.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -76.61 -37.57 56.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.267 177.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.499 HG13 HD22 ' A' ' 67' ' ' LEU . 57.4 t -59.09 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.619 177.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.43 HG21 HD13 ' A' ' 52' ' ' ILE . 15.0 p -63.43 -28.72 45.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.533 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -67.46 -42.17 83.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.216 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.69 -46.35 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 33' ' ' VAL . 57.1 mt -60.1 -55.63 22.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.44 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 47' ' ' SER . 4.0 mt-30 -61.38 -40.98 96.32 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.5 t -74.28 -30.21 61.99 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.305 -0.247 . . . . 0.0 111.539 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.414 ' HD3' ' OE2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -82.3 -28.86 31.46 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.544 -0.463 . . . . 0.0 110.313 174.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -116.23 83.34 12.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.716 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.58 -16.01 52.07 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.41 2.074 . . . . 0.0 112.783 -178.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.2 t -74.01 -22.36 59.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 109.952 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.2 mt -96.42 25.98 4.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.395 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -63.12 -25.05 68.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -89.46 36.92 0.85 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.459 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.493 ' HB2' HE21 ' A' ' 38' ' ' GLN . 70.1 m -80.12 88.83 5.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 174.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 90.9 m-20 -62.61 124.5 83.27 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.965 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 89.4 Cg_exo -53.01 -23.09 20.5 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.463 2.775 . . . . 0.0 113.904 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.08 -23.37 48.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -147.66 72.62 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.259 0.224 . . . . 0.0 110.792 -174.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.43 HD13 HG21 ' A' ' 34' ' ' VAL . 23.0 mt -90.95 122.12 42.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.533 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -99.9 140.61 33.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.639 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 49.3 mt -112.54 107.69 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.51 92.66 4.14 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 122.23 1.014 . . . . 0.0 110.103 176.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -61.52 -15.93 42.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.229 -174.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -75.15 -22.32 58.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.495 -174.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -96.9 -26.72 14.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.0 mt -58.61 123.88 17.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.848 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.06 150.64 97.47 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.636 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -46.61 -29.5 7.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.483 2.122 . . . . 0.0 112.542 173.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 t -56.73 -55.36 35.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -63.77 -46.16 86.52 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.414 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -59.17 -37.2 76.77 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.093 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -73.25 -45.08 57.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.973 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 29.9 mt-10 -66.47 -38.29 87.0 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.679 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 71' ' ' VAL . 77.3 mt -60.36 -56.83 16.69 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.363 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 71' ' ' VAL . 18.1 tt0 -55.36 -41.83 73.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -58.43 -36.96 74.43 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.302 0.572 . . . . 0.0 110.534 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -82.77 -45.74 14.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.87 -175.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.586 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.4 m -63.19 -36.01 74.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.04 0.448 . . . . 0.0 110.403 -177.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 30.6 p -71.75 -39.95 69.69 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.335 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -64.82 -21.56 66.81 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.611 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.644 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 29.3 t -91.14 -53.14 4.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.762 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.521 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -79.51 -35.68 39.7 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -171.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 72' ' ' THR . 95.2 mtt180 -67.89 -31.43 71.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -83.84 -49.85 8.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.033 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -128.01 97.78 4.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.014 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -67.32 -21.9 65.64 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.499 . . . . 0.0 110.774 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -134.36 86.17 36.26 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.12 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.29 -12.92 36.42 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.864 2.376 . . . . 0.0 111.815 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -117.13 159.9 21.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.217 174.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.156 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.799 -177.524 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.709 0.29 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 93.7 mt -75.56 121.12 21.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.346 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -64.15 99.45 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.127 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' SER . . . . . 0.504 ' HA ' ' OH ' ' A' ' 12' ' ' TYR . 26.8 m -100.1 164.73 11.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 7.4 p -73.21 74.85 1.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.581 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 47.5 mm -76.88 120.01 26.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 174.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.407 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 4.4 t -100.81 149.87 5.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.13 -172.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -134.17 127.89 32.92 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -140.64 151.6 44.73 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.149 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -97.5 131.59 43.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.287 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 209' ' ' LYS . . . . . 0.424 ' HD2' ' HA2' ' A' ' 31' ' ' GLY . 17.3 ttpp -113.58 119.2 42.07 Favored Pre-proline 0 C--N 1.318 -0.776 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.73 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -58.17 147.0 86.11 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.606 2.204 . . . . 0.0 111.625 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 76.4 mt 66.67 95.56 0.05 OUTLIER Pre-proline 0 C--O 1.235 0.315 0 O-C-N 123.871 0.732 . . . . 0.0 111.41 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.54 80.4 2.3 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.459 2.106 . . . . 0.0 112.144 178.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 33.8 tp -71.95 -37.51 69.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.151 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 27.5 p -96.95 75.06 2.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.003 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -108.81 108.12 60.53 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.82 151.89 81.52 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.568 2.179 . . . . 0.0 112.606 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.414 -1.215 . . . . 0.0 111.858 179.586 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 120.696 0.284 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -76.09 -4.85 43.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.43 -176.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -61.85 -48.87 78.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.381 -179.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.25 -26.93 65.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 0.0 110.492 -176.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -67.11 -30.94 71.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.0 -177.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -109.28 -29.82 8.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.947 0.403 . . . . 0.0 111.019 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.495 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 62.5 m -109.93 99.58 8.68 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.959 -177.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.78 149.79 64.55 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.79 135.63 53.19 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 123.185 2.59 . . . . 0.0 112.42 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -70.04 135.02 48.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.5 p -76.76 176.18 8.71 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -61.86 -46.85 87.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.372 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -54.84 -44.66 74.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.112 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -64.7 -46.23 83.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.186 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -58.03 -44.24 87.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.179 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -63.86 -43.09 97.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.875 0.369 . . . . 0.0 110.275 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -57.62 -47.27 82.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.186 176.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -48.07 83.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.036 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.649 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 59.7 p -60.87 -35.87 77.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.796 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.9 -35.93 67.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.954 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.516 ' O ' HD11 ' A' ' 75' ' ' LEU . 1.1 m-20 -70.05 -42.23 73.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.427 177.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.1 mt -56.72 -38.22 56.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.318 0.58 . . . . 0.0 110.646 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.1 -25.25 64.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.576 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -82.11 -15.75 52.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.057 0.456 . . . . 0.0 110.637 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.473 HD23 HD21 ' A' ' 75' ' ' LEU . 92.1 mt -77.41 134.4 66.5 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.531 -176.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.504 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 92.1 Cg_endo -80.45 171.27 14.97 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 123.042 2.495 . . . . 0.0 113.252 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.3 -46.24 44.15 Favored Glycine 0 CA--C 1.52 0.365 0 O-C-N 123.377 0.423 . . . . 0.0 114.048 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -47.75 -51.99 20.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.09 0.471 . . . . 0.0 111.684 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.56 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -79.64 -30.13 41.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.088 -174.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.48 -27.07 68.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.52 -31.27 79.13 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.058 -0.591 . . . . 0.0 112.177 174.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 36' ' ' ILE . 17.1 tpp180 -81.69 -41.69 20.96 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.799 -0.236 . . . . 0.0 110.377 177.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 80.2 t -56.22 -54.12 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.84 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.1 -31.46 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.582 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.64 -41.68 92.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.867 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.2 mt -64.25 -50.98 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.107 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' VAL . 43.2 mt -56.24 -59.88 2.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.161 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -63.14 -34.4 77.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.8 m -77.69 -33.08 53.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 122.026 -0.421 . . . . 0.0 111.754 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -77.13 -30.12 55.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.093 0.473 . . . . 0.0 109.966 174.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 35.0 mm-40 -115.52 84.23 11.91 Favored Pre-proline 0 N--CA 1.446 -0.665 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.41 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.48 -13.97 40.89 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.398 2.066 . . . . 0.0 112.352 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.2 t -79.56 -11.15 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.134 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.0 mt -105.76 32.29 4.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.434 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -80.99 -1.76 45.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.235 0.54 . . . . 0.0 110.496 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -97.4 17.13 18.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.682 0.754 . . . . 0.0 109.659 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.9 m -75.86 95.74 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.903 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -54.82 122.9 43.31 Favored Pre-proline 0 C--N 1.331 -0.205 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 173.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.19 -16.88 23.41 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.889 2.393 . . . . 0.0 112.459 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -82.55 -36.79 25.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.247 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -131.92 62.02 1.64 Allowed 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.894 -176.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.505 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 24.0 mt -74.0 119.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.173 0.511 . . . . 0.0 111.458 -175.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -103.99 131.37 51.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.342 178.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 39.8 mt -106.87 109.67 28.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.27 101.92 11.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.101 0.953 . . . . 0.0 110.543 176.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.81 -6.9 44.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.312 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.74 -30.54 45.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.767 0.317 . . . . 0.0 110.765 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.5 p -90.16 -26.07 20.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.95 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.45 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 38.4 mt -59.32 127.38 31.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.637 176.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -72.91 148.17 89.21 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.854 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -43.79 -36.2 7.51 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.567 2.178 . . . . 0.0 113.201 175.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.492 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 33.5 t -54.6 -56.96 13.51 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 175.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.401 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.2 m -59.18 -47.8 83.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.456 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 59' ' ' LEU . 87.5 mt -57.18 -40.37 77.21 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.115 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 18.3 tpt180 -71.1 -46.92 60.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.023 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 62' ' ' SER . 41.5 mt-10 -65.61 -38.64 90.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.408 . . . . 0.0 110.458 -177.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.537 ' O ' HG13 ' A' ' 71' ' ' VAL . 93.2 mt -62.0 -55.97 23.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.244 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -53.83 -47.21 71.16 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.484 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 69' ' ' ARG . 35.2 ttp180 -52.7 -42.45 64.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.329 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -79.48 -47.84 14.93 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.832 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.1 m -63.79 -35.33 72.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.955 0.407 . . . . 0.0 110.381 -176.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 40.6 p -75.73 -36.69 59.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.828 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.3 p -66.56 -19.32 65.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.749 0.309 . . . . 0.0 110.601 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.56 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 24.4 t -90.44 -51.1 5.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.609 178.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.516 HD11 ' O ' ' A' ' 21' ' ' ASP . 81.3 mt -79.87 -36.8 36.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -173.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 46.1 mtp180 -79.18 -4.74 51.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.105 0.479 . . . . 0.0 110.711 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -102.16 -34.22 9.36 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -148.57 105.77 3.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.412 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -54.18 -38.14 65.26 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.962 -174.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -127.38 96.46 33.43 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 172.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.415 ' HB3' ' HE3' ' A' ' 29' ' ' LYS . 49.5 Cg_exo -56.31 115.03 2.18 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.969 2.446 . . . . 0.0 112.65 -178.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -138.17 127.76 24.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.027 -178.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 CA-C-O 118.434 -0.793 . . . . 0.0 109.845 177.898 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.503 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.407 0.146 . . . . 0.0 110.958 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -139.23 156.43 47.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.773 0.32 . . . . 0.0 110.423 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -100.67 90.43 4.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 19.2 m -74.76 159.81 31.51 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.002 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 14.9 m -81.0 83.54 6.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.53 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 44.3 mm -75.1 133.11 32.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.08 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.649 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 88.8 t -104.88 122.91 58.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.419 -177.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 16.5 ttmm -107.09 117.34 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.507 171.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -127.79 141.88 51.46 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.538 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 27.0 mtpp -96.24 126.67 41.62 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.695 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -114.06 84.03 8.53 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.143 -177.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 5.2 Cg_exo -78.51 115.59 3.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.282 2.655 . . . . 0.0 113.086 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 50.7 tp -116.37 110.78 42.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.527 175.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.59 103.72 1.02 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.439 2.093 . . . . 0.0 112.414 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 80.5 mt -87.21 -15.99 36.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.132 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 5.5 p -73.76 86.13 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.593 176.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -138.45 122.3 11.41 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.943 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 178.65 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.389 2.059 . . . . 0.0 111.7 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.053 -1.415 . . . . 0.0 111.179 178.961 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 120.541 0.21 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -98.72 -32.7 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -177.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.46 -43.03 82.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.513 0.197 . . . . 0.0 110.545 -175.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -73.23 -16.68 61.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.761 0.315 . . . . 0.0 110.997 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -78.59 -43.85 25.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HE2' ' SG ' ' A' ' 7' ' ' CYS . 0.4 OUTLIER -71.38 -49.64 40.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.209 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.496 ' SG ' ' HE2' ' A' ' 6' ' ' LYS . 55.8 m -99.0 98.02 9.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.291 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.03 154.33 60.55 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.609 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.59 128.92 24.77 Favored 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 123.172 2.581 . . . . 0.0 112.14 -176.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -61.34 130.06 44.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.189 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.8 p -73.65 173.88 9.13 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.75 -47.3 86.23 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.725 -174.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -53.7 -41.95 67.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.489 . . . . 0.0 111.081 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -67.56 -46.96 71.19 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.121 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.3 mttt -58.73 -42.22 88.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.259 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -62.0 -44.41 96.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.909 0.385 . . . . 0.0 110.336 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.99 -41.41 78.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.426 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.842 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 1.5 mt -67.0 -36.04 81.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.859 -176.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.4 p -65.74 -29.13 69.61 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.867 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.22 -42.41 31.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.842 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.4 p30 -67.85 -45.67 73.94 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.196 -0.201 . . . . 0.0 110.974 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mt -57.25 -34.21 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.365 0.603 . . . . 0.0 110.17 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -71.39 -29.37 64.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.434 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 55.4 mtpt -78.92 -22.37 45.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.035 0.445 . . . . 0.0 110.568 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 75' ' ' LEU . 86.6 mt -72.51 138.76 80.79 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.521 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 48.9 Cg_endo -83.81 172.63 9.85 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.475 2.783 . . . . 0.0 112.799 178.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.03 -44.38 62.32 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.548 -0.358 . . . . 0.0 113.466 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.3 mp0 -46.52 -52.06 14.14 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.615 0.721 . . . . 0.0 111.31 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.565 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.2 mptp? -83.51 -25.7 30.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.816 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.5 mt -64.07 -27.08 68.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.311 177.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.78 92.08 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.046 -0.597 . . . . 0.0 111.625 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -76.74 -42.86 39.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.561 0.22 . . . . 0.0 110.72 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.55 HG13 HD22 ' A' ' 67' ' ' LEU . 59.9 t -56.12 -52.07 54.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.961 0.41 . . . . 0.0 110.731 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 52' ' ' ILE . 8.0 p -65.14 -32.25 57.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.625 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -63.61 -42.43 98.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 79.3 mt -62.79 -49.06 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.316 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.51 -56.97 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -61.51 -32.97 73.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.9 t -80.16 -37.2 33.89 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.219 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.581 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -72.8 -35.6 67.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 120.972 0.415 . . . . 0.0 110.172 175.935 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.521 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 25.4 mm-40 -114.12 84.63 9.26 Favored Pre-proline 0 N--CA 1.442 -0.833 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.969 -175.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.2 -13.31 39.32 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.334 2.023 . . . . 0.0 112.33 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.0 m -79.06 -7.2 57.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.238 0.542 . . . . 0.0 110.353 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -110.88 25.62 11.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.32 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.77 -16.13 60.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.912 0.387 . . . . 0.0 110.844 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.72 28.14 1.6 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.86 0.362 . . . . 0.0 111.061 177.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 p -80.05 97.71 6.93 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -57.3 123.93 63.79 Favored Pre-proline 0 CA--C 1.516 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.95 -21.23 25.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 123.075 2.517 . . . . 0.0 113.15 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.61 -22.08 37.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.06 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -143.64 75.41 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.307 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.478 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -92.05 121.81 42.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.648 0.261 . . . . 0.0 111.091 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -104.21 137.34 42.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.737 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 54.2 mt -110.83 109.98 30.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.632 0.253 . . . . 0.0 110.58 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -110.53 98.78 7.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.933 0.873 . . . . 0.0 110.474 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -64.66 -16.36 62.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.582 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -74.16 -27.51 60.87 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.659 -176.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.08 -26.63 17.38 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.921 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.8 mt -56.53 128.64 37.19 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.238 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.521 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 24.0 mttm -70.84 149.23 95.05 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.822 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -46.46 -38.84 21.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.16 1.907 . . . . 0.0 112.35 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.8 m -56.61 -50.45 71.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.992 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.3 m -62.14 -48.22 81.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.395 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.02 -34.96 70.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -73.76 -50.54 20.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.128 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.581 ' OE1' ' HD3' ' A' ' 40' ' ' ARG . 40.9 mt-10 -62.41 -40.76 97.59 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.712 0.292 . . . . 0.0 110.779 -178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.599 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.2 mt -57.1 -60.35 3.73 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.357 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.629 ' OE2' HG23 ' A' ' 72' ' ' THR . 6.1 tp10 -51.92 -52.35 50.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.346 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -55.9 -36.5 67.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.051 0.453 . . . . 0.0 110.941 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.13 -48.19 18.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.845 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -63.55 -36.19 75.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.825 0.345 . . . . 0.0 110.62 -175.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.629 HG23 ' OE2' ' A' ' 68' ' ' GLU . 0.9 OUTLIER -67.74 -39.26 84.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.1 p -65.62 -23.15 66.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.812 0.339 . . . . 0.0 110.573 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.565 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 49.1 t -90.01 -47.11 8.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.973 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 25' ' ' LEU . 74.8 mt -87.8 -44.17 11.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' THR . 90.4 mtt180 -66.83 -26.03 66.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.803 0.335 . . . . 0.0 111.208 -176.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -94.1 2.07 56.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.17 178.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -141.23 -144.3 0.16 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.417 ' HG3' ' N ' ' A' ' 80' ' ' LYS . 30.9 ptt180 -150.71 -51.73 0.13 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.627 0.251 . . . . 0.0 110.533 176.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.417 ' N ' ' HG3' ' A' ' 79' ' ' ARG . 54.9 tttm 178.33 122.91 0.2 Allowed Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.457 ' HG2' ' HG3' ' A' ' 26' ' ' PRO . 76.8 Cg_exo -48.63 111.87 0.53 Allowed 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.963 2.442 . . . . 0.0 112.383 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.54 -52.88 15.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.262 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.241 178.916 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.541 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.827 0.346 . . . . 0.0 110.933 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 56.3 tp -132.18 -48.11 0.92 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -158.01 96.27 1.45 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.404 0.621 . . . . 0.0 111.051 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 51.5 m -87.57 56.47 3.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.107 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 37.4 m 61.31 57.96 2.28 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.732 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.438 HD12 ' N ' ' B' ' 204' ' ' ILE . 2.3 mp -79.4 108.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 175.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.33 163.24 2.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.158 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 0.0 OUTLIER -159.24 141.85 14.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.114 169.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -140.93 159.62 41.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.896 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -104.98 128.86 53.46 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -119.86 85.82 34.82 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.053 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -61.62 -52.26 3.28 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.559 2.173 . . . . 0.0 111.254 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 33.7 tp 48.59 70.16 2.26 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -62.64 143.65 92.87 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.513 2.142 . . . . 0.0 111.708 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 8.6 mp 59.93 53.91 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.814 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 91.6 m -65.61 -37.1 85.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.412 0.625 . . . . 0.0 109.685 176.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -80.99 143.19 52.82 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.739 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.06 59.87 5.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.629 2.219 . . . . 0.0 112.275 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.753 -1.026 . . . . 0.0 111.664 179.357 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.3 m . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.718 0.294 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -60.21 -36.08 76.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.429 ' OE2' ' HD3' ' A' ' 8' ' ' LYS . 15.0 tp10 -64.0 -28.38 69.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.971 0.415 . . . . 0.0 111.001 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 -71.82 -35.83 70.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.1 0.476 . . . . 0.0 110.521 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.5 -45.72 9.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.87 -57.57 3.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.603 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.8 m 62.34 98.29 0.03 OUTLIER 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.838 0.711 . . . . 0.0 110.83 -175.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.429 ' HD3' ' OE2' ' A' ' 3' ' ' GLU . 0.5 OUTLIER -66.12 145.46 99.0 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.916 -179.782 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -64.75 152.63 81.32 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.901 2.4 . . . . 0.0 112.066 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.3 mmt -85.86 130.51 34.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.519 -178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 p -77.8 178.2 7.57 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 175.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.29 -49.59 77.27 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.728 -174.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.13 -49.63 63.33 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 109.711 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.41 -44.93 96.29 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.842 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -60.38 -41.81 94.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.402 177.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -64.73 -41.54 95.88 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.826 0.346 . . . . 0.0 110.396 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -57.49 -47.56 81.58 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.556 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -61.91 -41.06 97.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.731 178.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.9 p -63.81 -25.32 68.12 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.211 -0.93 . . . . 0.0 110.449 176.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.9 mt -84.73 -42.99 14.71 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.448 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.603 ' OD1' HG21 ' A' ' 71' ' ' VAL . 1.1 p30 -67.4 -41.36 85.06 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 121.258 -0.177 . . . . 0.0 110.785 177.206 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -58.43 -40.57 78.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.015 0.436 . . . . 0.0 110.269 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -68.34 -30.92 69.99 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 39.9 mttp -62.07 -35.37 78.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.978 0.418 . . . . 0.0 111.346 173.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.625 HD11 HG12 ' A' ' 71' ' ' VAL . 95.0 mt -68.35 135.79 91.06 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.549 -0.751 . . . . 0.0 112.313 -172.011 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.2 Cg_endo -80.83 172.09 13.59 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.342 2.695 . . . . 0.0 112.803 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.52 -43.46 52.69 Favored Glycine 0 C--O 1.237 0.332 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.378 -175.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 5.5 mp0 -48.62 -55.87 10.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.522 0.677 . . . . 0.0 111.148 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.584 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -80.37 -27.06 38.3 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.445 -174.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.0 mt -62.64 -27.75 69.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.626 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.574 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 36' ' ' ILE . 12.6 tpp180 -66.24 -41.52 89.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.671 0.272 . . . . 0.0 110.675 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 67' ' ' LEU . 93.7 t -56.85 -52.14 58.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.88 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 30' ' ' LEU . 22.2 t -64.17 -36.84 78.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.455 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -59.45 -41.63 90.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.206 177.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.1 mt -66.73 -48.69 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.24 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 33' ' ' VAL . 55.0 mt -58.88 -55.83 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.036 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 37.2 mt-30 -62.3 -34.1 75.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.3 t -78.28 -36.13 47.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -176.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.62 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 5.9 mpt_? -80.32 -27.88 38.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.424 177.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.635 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 60.0 mm-40 -114.21 87.05 12.66 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.851 178.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.12 -13.1 35.79 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.125 1.883 . . . . 0.0 112.109 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.9 t -72.7 -20.95 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.232 0.539 . . . . 0.0 109.803 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.1 mt -104.1 33.82 3.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.228 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -72.74 -17.65 61.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.505 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.71 41.86 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.778 0.799 . . . . 0.0 110.062 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.9 m -88.51 91.01 8.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.424 177.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 87.2 m-20 -60.04 123.22 71.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.19 177.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 59.4 Cg_exo -56.24 -19.04 26.09 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.253 2.635 . . . . 0.0 113.147 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.19 -27.82 38.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -146.85 78.67 1.5 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.921 -176.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 23.2 mt -92.25 125.74 44.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.205 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -104.55 119.63 39.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.651 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.446 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 48.2 mt -96.87 109.42 23.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.238 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 17.0 p-10 -109.39 98.62 7.99 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.931 0.872 . . . . 0.0 110.078 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -68.89 -0.35 5.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.802 -175.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -85.6 -24.69 27.06 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.95 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.2 p -101.78 -26.01 13.62 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.529 HD23 ' HG3' ' A' ' 41' ' ' GLU . 31.3 mt -53.8 128.78 31.2 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.647 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.635 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 23.1 mttm -71.91 150.99 92.97 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.657 178.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -47.11 -36.5 21.43 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.296 1.997 . . . . 0.0 112.426 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 25.6 t -54.4 -54.43 40.73 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.0 -49.62 76.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.668 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -57.38 -37.64 72.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.306 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.6 -45.97 23.55 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.085 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.7 mt-10 -63.92 -36.66 84.67 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.789 0.328 . . . . 0.0 110.457 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.538 HD22 HG13 ' A' ' 33' ' ' VAL . 83.6 mt -62.2 -56.1 22.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.116 174.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.16 -46.83 75.76 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.144 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -63.03 -31.93 73.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.795 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -78.53 -47.78 16.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.612 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.625 HG12 HD11 ' A' ' 25' ' ' LEU . 15.7 m -63.12 -42.47 96.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.14 0.495 . . . . 0.0 110.471 -176.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.404 ' N ' HG23 ' A' ' 71' ' ' VAL . 24.7 p -63.91 -36.66 84.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.933 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 82.9 p -67.73 -24.23 65.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.584 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.3 t -91.14 -32.35 15.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.433 -177.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.601 HD21 HD23 ' A' ' 25' ' ' LEU . 28.1 mt -97.79 -43.05 7.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.404 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 20.9 mtp180 -71.46 -10.7 60.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 110.377 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -106.76 -28.14 10.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.283 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -151.53 75.38 1.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.84 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.497 ' HD2' ' H ' ' A' ' 79' ' ' ARG . 0.1 OUTLIER -60.99 130.03 44.39 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.784 0.326 . . . . 0.0 110.158 176.016 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 51.9 tptt 58.15 74.89 0.58 Allowed Pre-proline 0 C--O 1.236 0.363 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.355 -172.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.41 97.48 1.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.084 2.523 . . . . 0.0 112.037 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -83.34 -30.83 27.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.412 0.625 . . . . 0.0 109.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.13 179.654 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.65 -18.17 42.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.057 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.89 29.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.674 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 32.4 p -172.07 156.26 3.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.847 0.356 . . . . 0.0 111.113 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 35.2 m -100.02 99.55 10.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.789 174.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.415 HD12 ' N ' ' B' ' 204' ' ' ILE . 4.0 mp -74.21 124.46 31.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.446 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 26.9 t -104.9 105.31 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.337 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.2 ttmm -96.01 118.02 31.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.456 ' CZ ' HD22 ' A' ' 30' ' ' LEU . 10.3 p90 -131.75 137.32 48.15 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.67 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 59.0 mttm -85.7 111.4 20.08 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -73.11 121.32 84.81 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.293 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.92 143.82 86.46 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.494 2.129 . . . . 0.0 111.151 175.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.4 ' N ' ' HD3' ' B' ' 212' ' ' PRO . 87.4 mt 60.7 65.37 2.11 Favored Pre-proline 0 C--N 1.329 -0.321 0 O-C-N 123.664 0.602 . . . . 0.0 111.351 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 212' ' ' PRO . . . . . 0.4 ' HD3' ' N ' ' B' ' 211' ' ' LEU . 24.7 Cg_exo -63.79 -38.45 39.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.268 1.978 . . . . 0.0 111.301 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.31 71.14 4.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 174.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 5.8 t -69.52 121.39 16.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.489 0.661 . . . . 0.0 111.392 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.439 ' HA ' ' HD3' ' B' ' 216' ' ' PRO . 12.5 pt20 -87.55 143.12 33.52 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.943 177.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 216' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' B' ' 215' ' ' GLN . 12.1 Cg_exo -70.67 77.22 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.976 2.451 . . . . 0.0 112.774 -178.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 119.005 -0.886 . . . . 0.0 111.406 177.293 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.672 ' O ' ' HG2' ' A' ' 4' ' ' GLU . 22.8 t . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -59.58 -35.59 74.57 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.16 -36.34 77.35 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.703 0.229 . . . . 0.0 111.585 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.672 ' HG2' ' O ' ' A' ' 1' ' ' SER . 11.1 pt-20 -70.96 -27.45 63.75 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 110.529 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -86.12 -28.21 24.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.402 0.62 . . . . 0.0 110.385 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -70.05 -40.87 74.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.451 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 m -84.05 99.35 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.382 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -75.94 145.19 77.25 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.584 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.9 124.34 13.41 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.494 2.129 . . . . 0.0 110.962 176.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.495 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.2 mmt -57.6 128.7 38.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 p -73.07 175.61 6.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.892 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.311 -174.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -56.3 -40.18 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.158 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.11 -46.4 81.16 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.719 178.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.0 mttt -60.98 -39.56 90.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.394 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -64.2 -44.74 91.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -58.38 -44.24 88.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.829 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.93 -39.89 79.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.819 -176.592 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.49 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 87.5 p -63.48 -25.77 68.41 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.715 -0.615 . . . . 0.0 110.328 175.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.2 mt -82.69 -44.76 15.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.164 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.829 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.6 p30 -62.09 -41.19 97.94 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.409 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.437 ' HA ' HD12 ' A' ' 25' ' ' LEU . 84.6 mt -62.94 -40.11 87.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.907 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -68.42 -28.5 67.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.962 0.411 . . . . 0.0 111.213 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.5 mtpp -78.25 -16.88 57.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 84.5 mt -79.3 132.56 62.35 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.619 -176.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 78.3 Cg_endo -76.69 172.18 16.68 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 123.199 2.599 . . . . 0.0 113.085 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.03 -45.54 50.98 Favored Glycine 0 C--N 1.334 0.442 0 O-C-N 123.301 0.376 . . . . 0.0 113.927 -172.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -49.79 -55.31 14.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.415 0.626 . . . . 0.0 110.993 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.9 mptp? -76.5 -31.43 57.71 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.944 -174.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mt -58.39 -31.05 67.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.489 175.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.25 -34.53 89.48 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.268 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -79.03 -39.91 32.79 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.584 0.23 . . . . 0.0 110.499 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.542 HG13 HD22 ' A' ' 67' ' ' LEU . 93.3 t -56.18 -55.09 20.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.685 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.544 HG21 HD13 ' A' ' 52' ' ' ILE . 12.0 p -63.63 -30.77 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.638 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -65.26 -41.77 93.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.908 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.8 mt -65.99 -41.22 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.903 177.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.527 HG23 HD21 ' A' ' 59' ' ' LEU . 72.8 mt -62.41 -60.56 2.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.218 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -65.83 -29.67 70.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -78.28 -38.79 41.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.05 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.462 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 9.6 mpt_? -76.4 -31.92 58.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.577 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.633 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 49.4 mm-40 -112.72 85.26 7.35 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.441 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.76 -12.26 30.71 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.363 2.042 . . . . 0.0 112.567 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -82.29 -5.27 58.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 0.0 110.574 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.5 mt -115.63 27.42 9.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.02 177.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -80.3 -17.14 52.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.252 0.549 . . . . 0.0 110.476 -174.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -92.85 20.66 6.34 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.807 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 66.8 m -68.78 105.26 2.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.177 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.644 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -50.6 120.86 13.57 Favored Pre-proline 0 N--CA 1.463 0.187 0 O-C-N 123.118 0.262 . . . . 0.0 110.534 171.576 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.7 Cg_exo -59.08 -23.08 67.25 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.787 2.325 . . . . 0.0 111.556 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 21.9 m-20 -71.77 -35.96 70.21 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.643 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB2' ' OD1' ' A' ' 48' ' ' ASN . 20.5 mm-40 -138.64 72.1 1.4 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.035 0.379 . . . . 0.0 111.041 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.544 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -82.79 120.7 34.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.009 0.433 . . . . 0.0 111.136 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 19.0 mm-40 -100.84 122.69 43.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.053 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.5 mt -91.04 108.76 20.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.952 175.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -107.19 98.85 8.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.163 0.982 . . . . 0.0 110.309 177.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HD1' ' CD2' ' A' ' 64' ' ' LEU . 93.5 m-85 -70.67 -1.04 10.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.137 -174.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -84.35 -29.28 26.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.932 0.396 . . . . 0.0 110.765 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.6 p -90.7 -32.21 16.27 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' A' ' 41' ' ' GLU . 33.3 mt -53.18 126.98 22.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.118 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.633 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 27.5 mttm -66.03 147.58 98.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.5 -30.44 21.19 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.362 2.042 . . . . 0.0 111.762 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.482 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 13.6 m -60.51 -52.23 66.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 174.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -61.13 -46.46 90.47 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.461 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.4 ' CD2' ' HD1' ' A' ' 56' ' ' PHE . 78.6 mt -58.87 -39.18 80.62 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.843 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -68.23 -48.24 65.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.075 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 62' ' ' SER . 17.3 mm-40 -66.48 -40.72 89.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.853 -178.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.542 HD22 HG13 ' A' ' 33' ' ' VAL . 75.6 mt -57.15 -55.39 35.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.682 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -54.08 -42.4 69.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.91 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -59.86 -43.03 94.92 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.326 0.584 . . . . 0.0 110.167 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -74.88 -46.55 35.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.969 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.572 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.2 m -63.9 -38.1 81.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.074 0.464 . . . . 0.0 110.727 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.7 p -72.8 -38.44 67.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.056 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.2 p -64.84 -19.57 65.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 31.4 t -90.84 -54.83 3.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.65 177.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -78.85 -27.46 44.16 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 57.1 mtp180 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.621 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -94.83 -42.44 8.7 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -134.96 90.65 2.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.079 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -65.86 120.86 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 174.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 65.07 82.41 0.21 Allowed Pre-proline 0 C--O 1.235 0.339 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -170.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.41 59.86 2.57 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.402 2.735 . . . . 0.0 113.04 -176.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -80.26 104.04 10.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.19 0.519 . . . . 0.0 109.944 174.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.414 -0.803 . . . . 0.0 109.868 178.872 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.447 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.74 0.305 . . . . 0.0 110.459 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 64.5 mt -75.7 81.15 2.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.103 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -142.49 158.08 44.07 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.776 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 27.3 m -141.72 -163.67 1.62 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 19.1 m -111.84 118.17 34.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.661 0.267 . . . . 0.0 110.802 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 10.6 pt -85.16 154.61 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.619 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.49 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 61.3 t -121.12 113.82 41.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.633 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.496 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 19.5 ttmm -92.67 116.65 29.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -129.57 143.31 50.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.245 0.545 . . . . 0.0 110.55 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 44.1 mttp -94.61 114.75 26.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.355 176.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 209' ' ' LYS . . . . . 0.407 ' HD2' HG11 ' A' ' 34' ' ' VAL . 81.9 tttt -79.17 112.59 29.26 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-O 120.808 0.337 . . . . 0.0 110.216 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.59 58.02 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.901 2.4 . . . . 0.0 112.444 -176.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.407 ' HG ' HD22 ' B' ' 213' ' ' LEU . 24.9 tp -154.89 87.32 3.36 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.887 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.52 -7.21 8.8 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.618 2.212 . . . . 0.0 113.149 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 213' ' ' LEU . . . . . 0.407 HD22 ' HG ' ' B' ' 211' ' ' LEU . 2.9 mm? 57.57 48.69 13.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.437 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.9 t -148.26 150.63 34.03 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.318 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.484 ' H ' ' HD2' ' B' ' 216' ' ' PRO . 50.5 tt0 -169.77 -52.08 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.887 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 216' ' ' PRO . . . . . 0.484 ' HD2' ' H ' ' B' ' 215' ' ' GLN . 96.3 Cg_endo -79.41 165.33 23.28 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.714 1.609 . . . . 0.0 112.418 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.247 -1.307 . . . . 0.0 111.47 178.183 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 m . . . . . 0 N--CA 1.479 0.989 0 CA-C-O 120.735 0.302 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -98.31 -42.96 7.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.14 -24.64 67.46 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -173.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.56 -21.72 66.5 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.088 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -86.47 -34.02 20.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.122 0.487 . . . . 0.0 110.467 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -77.97 -45.06 24.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.472 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.7 m 63.86 102.23 0.03 OUTLIER 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.628 0.58 . . . . 0.0 112.316 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.56 144.41 97.69 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 170.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.9 129.57 21.12 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.78 2.32 . . . . 0.0 110.993 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.541 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -64.67 128.14 34.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.567 -177.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.4 p -73.53 174.45 8.23 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.7 -46.7 88.28 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.475 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.84 -44.23 77.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.368 . . . . 0.0 111.042 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -63.32 -46.09 88.29 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.913 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.6 mttt -61.25 -39.26 89.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.497 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.8 ttp180 -62.91 -43.62 98.29 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -56.75 -46.13 81.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.167 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.565 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -65.65 -33.17 75.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.464 -175.116 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.4 p -70.1 -27.16 64.37 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.51 -0.744 . . . . 0.0 109.986 175.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 85.8 mt -80.91 -46.01 15.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.201 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.587 ' CG ' HG21 ' A' ' 71' ' ' VAL . 1.3 p30 -65.44 -42.27 92.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.21 -0.196 . . . . 0.0 111.302 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' A' ' 25' ' ' LEU . 35.1 mt -60.37 -41.5 87.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.016 0.436 . . . . 0.0 110.493 176.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -65.14 -24.12 67.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.585 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.6 mtpp -85.89 -7.63 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.476 HD11 HG12 ' A' ' 71' ' ' VAL . 80.4 mt -86.23 137.67 34.78 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.571 -177.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -80.32 167.31 19.56 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.259 2.639 . . . . 0.0 112.841 177.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.01 -46.1 41.72 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 114.39 0.516 . . . . 0.0 114.39 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -53.67 -51.28 63.69 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.451 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.755 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -73.19 -32.73 64.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.642 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.553 HD21 ' CD1' ' B' ' 207' ' ' PHE . 10.6 tp -62.59 -24.63 67.66 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.65 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.87 99.51 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.909 -0.662 . . . . 0.0 111.493 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.1 tpm_? -67.85 -40.99 83.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.217 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.533 HG13 HD22 ' A' ' 67' ' ' LEU . 61.2 t -59.0 -58.15 8.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.008 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.13 -27.65 42.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.796 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -68.29 -41.96 80.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.301 -0.409 . . . . 0.0 109.964 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.58 HG13 ' HE ' ' A' ' 32' ' ' ARG . 61.8 mt -62.11 -43.47 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 120.974 0.416 . . . . 0.0 110.31 177.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.487 HG12 HD11 ' A' ' 67' ' ' LEU . 53.2 mt -65.02 -58.5 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.402 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 25.0 mt-30 -63.07 -28.47 70.11 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -173.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -89.95 -27.74 19.61 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.489 -0.484 . . . . 0.0 112.123 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 40' ' ' ARG . 5.0 mpt_? -81.89 -22.94 36.59 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.355 171.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -125.0 65.12 46.39 Favored Pre-proline 0 N--CA 1.442 -0.867 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.936 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -52.47 -17.93 7.4 Favored 'Trans proline' 0 N--CA 1.478 0.601 0 C-N-CA 122.971 2.447 . . . . 0.0 113.284 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.4 m -66.3 -21.85 66.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.963 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.59 41.95 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.036 0.446 . . . . 0.0 110.306 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -73.56 -15.55 61.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.154 -174.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -96.52 35.1 1.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.875 0.369 . . . . 0.0 111.213 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 50.2 m -81.33 89.38 6.08 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 175.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.441 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 86.3 m-20 -61.35 123.44 76.23 Favored Pre-proline 0 CA--C 1.52 -0.209 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.126 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 71.1 Cg_exo -53.17 -21.74 17.68 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.654 2.903 . . . . 0.0 114.268 -174.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 4.6 p-10 -76.11 -36.3 58.92 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.875 -177.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -143.7 77.5 1.56 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.449 HD12 ' CE1' ' B' ' 207' ' ' PHE . 26.2 mt -85.84 128.42 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.214 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -101.15 117.87 35.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 52.8 mt -90.38 108.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' B' ' 204' ' ' ILE . 12.2 t70 -105.11 99.15 8.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -68.18 -13.37 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.547 -172.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -79.38 -35.26 41.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.789 0.328 . . . . 0.0 110.559 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.4 p -80.91 -21.89 40.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.994 176.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 25.0 mt -67.16 135.62 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.494 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -76.54 147.45 78.64 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.005 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -42.94 -40.46 8.45 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.929 2.42 . . . . 0.0 113.05 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -58.13 -50.22 74.25 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.036 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -47.91 83.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.263 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.82 -37.56 71.37 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.023 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -70.63 -52.11 23.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.174 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -62.99 -39.34 94.44 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 111.059 -177.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.533 HD22 HG13 ' A' ' 33' ' ' VAL . 85.9 mt -60.24 -57.97 10.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.682 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.513 ' HA ' HG22 ' A' ' 71' ' ' VAL . 7.9 tt0 -58.77 -45.79 88.99 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.726 0.298 . . . . 0.0 111.155 -178.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -57.67 -30.15 65.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.259 0.552 . . . . 0.0 110.295 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 65.1 t80 -82.88 -49.2 9.91 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.919 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.587 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.0 m -60.81 -36.18 69.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.239 0.543 . . . . 0.0 110.482 -176.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.494 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 22.3 p -69.95 -39.91 75.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 92.4 p -65.63 -20.07 66.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.795 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.755 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.5 t -90.76 -53.49 4.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.762 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.47 HD21 HD23 ' A' ' 25' ' ' LEU . 71.1 mt -77.28 -36.0 54.66 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -172.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 72' ' ' THR . 98.3 mtt180 -75.33 -7.62 54.46 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.249 0.547 . . . . 0.0 110.472 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -105.85 -47.1 3.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.166 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -134.28 87.52 2.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.518 -173.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -75.1 133.94 41.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 59.53 71.71 0.88 Allowed Pre-proline 0 N--CA 1.464 0.264 0 O-C-N 123.617 0.573 . . . . 0.0 110.174 -171.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -75.39 41.45 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.234 2.623 . . . . 0.0 113.033 -177.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -71.92 -33.57 68.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.192 0.52 . . . . 0.0 110.141 178.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.597 -0.716 . . . . 0.0 109.692 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 54.2 t30 . . . . . 0 N--CA 1.48 1.054 0 CA-C-O 120.802 0.334 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 30.1 tp -88.48 -33.73 17.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 110.116 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -65.15 119.35 10.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.522 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 21.4 m -101.23 172.85 6.75 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.027 -175.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 29.4 t -83.94 89.03 7.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.976 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 55' ' ' ASP . 39.3 mm -85.74 121.55 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.093 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.442 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 58.2 t -85.27 117.73 30.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.328 -174.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -105.63 77.95 1.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.605 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.553 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.0 p90 -92.01 158.16 16.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.217 0.532 . . . . 0.0 110.478 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 12.4 mptt -106.73 135.26 48.58 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.624 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -121.03 81.24 35.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.244 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.95 -15.66 20.76 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.533 2.155 . . . . 0.0 111.914 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 94.1 mt -121.93 101.68 41.85 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.475 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -78.82 56.47 5.99 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.487 2.125 . . . . 0.0 112.658 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 213' ' ' LEU . . . . . 0.507 ' H ' HD23 ' B' ' 213' ' ' LEU . 2.4 pt? -98.24 169.41 9.6 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 3.8 p -147.0 171.78 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.854 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' B' ' 215' ' ' GLN . 3.9 pt20 -147.03 111.27 4.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.232 0.539 . . . . 0.0 110.647 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -89.15 45.28 0.83 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.176 2.584 . . . . 0.0 111.926 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.454 -1.192 . . . . 0.0 111.649 -178.06 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.796 0.332 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -98.84 -4.99 31.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.674 0.274 . . . . 0.0 111.466 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -63.39 -43.02 98.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.166 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -59.15 -27.23 65.44 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.432 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -83.74 -29.42 27.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.222 0.534 . . . . 0.0 110.441 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -76.31 -28.63 57.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.808 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.7 m -90.86 99.09 12.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.392 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -75.75 144.78 77.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.34 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.51 135.93 51.97 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.847 2.365 . . . . 0.0 111.534 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -72.66 131.29 42.22 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.826 -175.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 p -76.06 176.71 7.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.782 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.33 -47.88 84.12 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.597 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -53.09 -47.61 68.42 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.399 0.618 . . . . 0.0 110.024 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -63.86 -45.03 91.29 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.963 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 96.2 mttt -59.2 -44.6 92.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.396 175.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.475 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 50.0 ttp85 -59.48 -47.62 84.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.163 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -58.85 -51.94 67.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.968 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.68 -49.82 67.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.827 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 93.5 p -62.57 -30.81 71.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.918 0.389 . . . . 0.0 111.076 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 94.0 mt -73.55 -41.98 62.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.798 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 23.0 m-20 -67.26 -41.51 85.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.291 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' HD12 ' A' ' 25' ' ' LEU . 95.6 mt -58.1 -41.83 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -66.65 -27.59 67.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.532 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.92 -24.82 43.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.061 0.458 . . . . 0.0 110.451 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 75' ' ' LEU . 93.1 mt -66.67 135.49 94.46 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.398 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.8 Cg_endo -80.49 170.08 16.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.951 2.434 . . . . 0.0 112.858 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.59 -44.0 46.35 Favored Glycine 0 CA--C 1.519 0.329 0 O-C-N 123.195 0.309 . . . . 0.0 113.327 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.3 mp0 -45.43 -54.09 7.83 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.5 0.667 . . . . 0.0 111.203 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.665 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -82.71 -29.42 29.84 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.91 -175.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.74 -27.64 68.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.443 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.3 -28.85 71.6 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.139 174.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.464 ' O ' HG13 ' A' ' 36' ' ' ILE . 14.5 tpp180 -84.31 -43.04 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 122.585 -0.362 . . . . 0.0 110.335 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 43.4 t -55.07 -54.16 26.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.49 -29.86 48.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.526 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -66.01 -39.86 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.638 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.5 mt -66.93 -49.97 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.949 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' VAL . 50.0 mt -56.95 -59.73 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.089 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -62.48 -32.46 73.36 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.9 t -80.24 -32.57 38.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -82.58 -25.13 33.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 121.92 -0.488 . . . . 0.0 110.21 175.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.8 mm-40 -117.58 82.08 15.31 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.523 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.11 -15.11 45.91 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.584 2.189 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.9 t -78.31 -24.26 46.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 109.761 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.55 17.94 5.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.199 0.523 . . . . 0.0 110.22 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -74.0 -10.73 59.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.476 0.655 . . . . 0.0 109.683 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -84.22 4.93 28.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.257 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.0 m -67.48 97.84 0.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.299 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 89.8 m-20 -60.34 122.81 69.93 Favored Pre-proline 0 N--CA 1.452 -0.354 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 79.0 Cg_exo -52.09 -26.03 24.6 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.664 2.909 . . . . 0.0 113.451 -174.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -71.01 -29.68 65.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.186 -177.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -143.65 76.07 1.5 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.944 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.7 mt -88.4 126.91 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -108.1 132.55 53.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.775 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.0 mt -104.02 108.84 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 174.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -110.87 97.27 6.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.923 0.868 . . . . 0.0 110.601 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -68.12 -9.27 45.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.937 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.432 ' HG3' HD21 ' B' ' 200' ' ' LEU . 36.6 mm-40 -79.95 -21.4 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.472 -177.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.5 p -99.02 -25.24 14.62 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.47 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 23.3 mt -57.9 130.42 46.45 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.388 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -74.32 148.18 85.89 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.93 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -48.1 -33.93 22.31 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.75 2.3 . . . . 0.0 112.398 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.6 m -57.82 -53.32 59.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.46 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -62.33 -48.45 79.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.739 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.24 -36.68 71.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -69.44 -50.24 47.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.816 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.35 -38.94 91.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.548 ' O ' HG13 ' A' ' 71' ' ' VAL . 85.1 mt -61.22 -56.03 25.26 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.342 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -55.14 -49.77 70.96 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.802 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -55.68 -38.34 69.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.674 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -75.85 -50.08 16.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.726 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.548 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -62.82 -35.79 72.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 -175.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.511 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.7 p -74.61 -38.46 62.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.663 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.6 p -64.99 -19.43 65.99 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.559 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.665 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.4 t -91.02 -55.02 3.71 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.74 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 25' ' ' LEU . 75.1 mt -74.28 -34.5 63.57 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -174.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 72' ' ' THR . 28.2 mtp180 -80.07 8.77 6.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.276 0.56 . . . . 0.0 110.226 177.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -114.79 -49.89 2.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.856 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -142.92 86.62 1.94 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.201 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -72.08 -18.16 61.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.976 0.417 . . . . 0.0 111.312 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -129.5 87.58 52.64 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.71 -152.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.082 2.522 . . . . 0.0 112.09 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -68.55 -22.1 64.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.025 0.44 . . . . 0.0 110.757 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.461 ' HB3' ' HB3' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.538 -0.744 . . . . 0.0 110.336 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.667 0.27 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.432 HD21 ' HG3' ' A' ' 57' ' ' GLU . 2.4 pt? -151.9 150.62 30.26 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.773 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -96.59 68.97 2.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.089 0.471 . . . . 0.0 110.484 -177.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 4.6 m -64.0 -45.67 87.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.255 0.55 . . . . 0.0 109.528 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 31.8 t -173.37 -55.09 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.784 -1.098 . . . . 0.0 108.331 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.92 77.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.284 174.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.427 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 39.6 t -82.36 133.93 28.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.842 -175.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -116.65 119.9 36.97 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -129.86 137.88 50.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.155 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -89.5 115.02 26.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.952 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 209' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' B' ' 209' ' ' LYS . 1.5 ttpm? -133.9 69.76 75.11 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.481 ' O ' ' HD3' ' B' ' 212' ' ' PRO . 37.9 Cg_exo -60.1 -24.09 75.62 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.081 2.521 . . . . 0.0 112.41 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.423 HD21 ' OG1' ' B' ' 214' ' ' THR . 58.3 tp -104.57 101.66 29.41 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.235 177.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 212' ' ' PRO . . . . . 0.481 ' HD3' ' O ' ' B' ' 210' ' ' PRO . 16.7 Cg_exo -68.55 -52.51 0.43 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.745 2.296 . . . . 0.0 111.106 175.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.74 142.57 12.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.946 175.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 214' ' ' THR . . . . . 0.423 ' OG1' HD21 ' B' ' 211' ' ' LEU . 9.4 m -87.45 92.35 9.05 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -130.65 81.72 66.79 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.853 0.359 . . . . 0.0 111.12 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -79.02 -12.85 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.211 1.941 . . . . 0.0 110.793 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 119.039 -0.867 . . . . 0.0 110.977 178.903 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 120.753 0.311 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -66.06 -33.39 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.458 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -62.58 -35.97 81.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.919 0.39 . . . . 0.0 110.413 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.05 -44.97 52.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.137 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -79.02 -34.85 43.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.62 0.247 . . . . 0.0 111.629 -175.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -88.5 -34.68 17.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.62 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.3 m 64.55 100.29 0.04 OUTLIER 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -72.36 144.32 86.64 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.046 173.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -66.36 124.23 12.22 Favored 'Trans proline' 0 C--O 1.236 0.383 0 C-N-CA 122.801 2.334 . . . . 0.0 111.667 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -58.75 125.76 24.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.904 -176.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 p -72.49 175.22 6.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.15 -49.24 78.63 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.874 0.306 . . . . 0.0 110.356 -175.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -55.12 -41.74 72.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.08 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.85 -46.02 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.938 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.67 -42.89 89.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.416 176.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -63.95 -43.5 95.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.298 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -58.85 -43.06 90.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.369 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -65.64 -38.4 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.275 -177.44 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.8 p -64.55 -28.13 69.43 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 119.979 -0.689 . . . . 0.0 110.093 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.59 -41.21 19.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.459 -178.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.687 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -67.47 -40.87 85.32 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.682 177.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.7 mt -58.78 -40.07 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.093 0.473 . . . . 0.0 110.197 175.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -69.87 -29.4 66.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.824 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 47.2 mttp -64.13 -34.18 77.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.247 0.546 . . . . 0.0 110.966 173.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.671 HD11 HG12 ' A' ' 71' ' ' VAL . 95.4 mt -69.26 131.0 90.61 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.214 -172.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -77.54 172.9 15.04 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 123.525 2.817 . . . . 0.0 112.431 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.33 -45.94 52.38 Favored Glycine 0 CA--C 1.518 0.266 0 O-C-N 123.324 0.39 . . . . 0.0 113.846 -172.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.534 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 9.0 mp0 -47.26 -52.47 15.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.643 0.735 . . . . 0.0 111.034 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.577 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 2.1 mptp? -78.36 -23.8 46.72 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.155 -173.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.462 ' HA ' HD23 ' A' ' 30' ' ' LEU . 11.4 mt -62.11 -27.37 68.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.124 177.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.29 -35.99 92.41 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.067 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 36' ' ' ILE . 15.5 tpp180 -78.92 -40.83 31.08 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.199 -0.201 . . . . 0.0 110.698 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.5 t -57.3 -53.62 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.59 -30.71 51.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.963 0.411 . . . . 0.0 110.357 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -65.89 -40.98 92.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.962 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 32' ' ' ARG . 64.8 mt -65.85 -50.89 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.975 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.8 mt -58.56 -58.59 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 -178.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -61.01 -32.53 72.12 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.7 t -79.62 -38.68 33.29 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -176.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 9.1 mpt_? -75.6 -27.83 58.67 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.074 176.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.6 mm-40 -115.78 84.16 12.53 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.122 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.82 -12.83 36.08 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.363 2.042 . . . . 0.0 111.966 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.4 m -79.76 -8.62 59.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.375 177.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.6 mt -113.1 26.96 10.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.09 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -69.69 -23.39 63.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.403 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.69 21.43 1.53 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.024 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.0 m -75.1 91.08 2.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.83 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -53.0 125.86 41.63 Favored Pre-proline 0 CA--C 1.52 -0.211 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.998 173.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.27 -15.18 17.74 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.836 2.357 . . . . 0.0 112.159 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.514 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 16.7 m-20 -85.2 -29.79 24.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.555 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -139.6 59.68 1.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.697 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 18.9 mt -69.64 125.0 26.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.083 0.468 . . . . 0.0 111.508 -175.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -104.93 126.33 51.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.616 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 60.2 mt -107.28 108.3 24.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 173.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.455 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.5 p-10 -110.53 103.6 12.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.83 0.824 . . . . 0.0 110.762 176.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -69.68 -12.28 61.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.556 -174.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -74.56 -27.68 60.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.458 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.1 p -95.54 -28.03 15.07 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.097 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.6 mt -56.62 127.1 29.7 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 177.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -71.46 146.95 92.27 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -43.5 -32.85 3.92 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.864 2.376 . . . . 0.0 113.004 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.46 -54.72 43.87 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.686 0.279 . . . . 0.0 110.645 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -60.88 -47.73 85.03 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.234 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.3 mt -55.74 -39.87 71.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.92 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.3 tpt180 -70.47 -49.25 50.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.244 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -63.8 -36.56 84.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.775 0.321 . . . . 0.0 110.632 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.551 ' O ' HG13 ' A' ' 71' ' ' VAL . 84.8 mt -60.82 -56.46 20.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.998 174.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -54.48 -43.03 71.4 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.99 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -60.16 -39.29 85.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.375 0.607 . . . . 0.0 110.35 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -75.85 -47.07 27.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.775 -176.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.671 HG12 HD11 ' A' ' 25' ' ' LEU . 11.7 m -64.08 -42.71 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.07 0.462 . . . . 0.0 110.641 -175.051 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 25.3 p -67.69 -32.29 72.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.491 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.7 t -66.15 -25.32 66.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.263 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.7 t -91.72 -45.37 8.47 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.977 0.418 . . . . 0.0 110.414 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 25' ' ' LEU . 26.7 mt -85.51 -28.5 24.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -169.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 30.7 mtp180 -80.43 8.8 6.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.476 0.655 . . . . 0.0 110.116 177.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -120.65 -50.34 2.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.077 170.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' A' ' 75' ' ' LEU . 75.3 mmtt -132.63 109.74 9.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.197 177.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 79' ' ' ARG . 10.8 ptp180 -87.3 -11.91 48.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.517 0.199 . . . . 0.0 111.38 -176.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -136.78 68.77 58.87 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.852 0.358 . . . . 0.0 110.782 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -79.46 49.29 3.12 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.084 2.523 . . . . 0.0 111.982 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -156.08 157.21 35.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.229 -178.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.84 -0.6 . . . . 0.0 109.953 178.187 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 86.5 mt 51.87 46.91 25.8 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.55 0.531 . . . . 0.0 111.133 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 57.7 tp60 -160.34 100.45 1.35 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.586 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 30.6 p -138.87 -63.33 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.925 174.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 9.0 t -172.76 132.02 0.55 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.279 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 58.3 mt -122.88 104.79 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.14 0.495 . . . . 0.0 110.097 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.499 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 47.3 t -92.91 108.03 19.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.62 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 4.4 ttmp? -104.28 109.8 21.77 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.135 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -126.84 151.1 48.8 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.044 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.609 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 67.6 mttm -96.75 130.74 43.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 177.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -101.34 95.17 4.68 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.822 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.609 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 5.2 Cg_exo -77.84 71.22 6.67 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 123.19 2.593 . . . . 0.0 112.433 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.87 116.61 43.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 176.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.06 45.37 1.79 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 122.927 2.418 . . . . 0.0 112.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 34.0 tp -122.86 44.91 2.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 110.285 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 28.3 m -72.42 -36.92 68.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.331 0.586 . . . . 0.0 109.911 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -135.79 102.56 10.27 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.94 178.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -47.73 127.27 13.91 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.094 2.529 . . . . 0.0 112.439 -178.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.951 -0.916 . . . . 0.0 111.661 -177.673 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.79 -22.81 25.67 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.339 -177.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.29 -44.48 94.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.127 0.489 . . . . 0.0 110.138 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -68.7 -21.15 64.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.344 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -79.52 -36.43 38.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.32 0.581 . . . . 0.0 109.994 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -69.77 -51.02 37.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.119 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.6 m -79.36 100.48 7.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.202 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -68.27 144.17 96.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.26 149.72 88.23 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.843 2.362 . . . . 0.0 112.075 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -85.95 119.89 26.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 p -67.6 174.64 3.35 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -46.95 84.29 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.762 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -51.26 -48.7 62.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.682 0.753 . . . . 0.0 109.943 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -65.15 -46.06 82.47 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.062 -175.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.03 -38.98 73.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.268 176.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 16' ' ' ARG . 39.1 ttp180 -62.76 -44.37 96.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.327 175.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -59.74 -43.47 94.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.502 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.778 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -66.42 -38.06 86.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.305 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.7 p -65.37 -26.8 68.17 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.628 -0.67 . . . . 0.0 110.359 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.86 -43.87 19.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.396 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.778 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -64.09 -43.8 94.26 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.775 178.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.21 -41.96 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.931 0.396 . . . . 0.0 110.724 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -70.25 -27.44 64.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -74.5 -33.97 62.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.491 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.561 HD23 HD21 ' A' ' 75' ' ' LEU . 77.9 mt -56.94 138.19 79.13 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.333 -175.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.693 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 59.0 Cg_endo -79.22 163.24 25.22 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 123.521 2.814 . . . . 0.0 111.583 178.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.31 -27.15 60.13 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.151 -0.931 . . . . 0.0 114.855 -169.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.514 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.4 mp0 -63.07 -54.47 37.46 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.594 0.697 . . . . 0.0 109.711 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.693 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 3.8 mptt -72.22 -26.7 62.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.902 -176.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.4 mt -63.02 -25.7 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.014 176.185 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.26 -33.57 86.46 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.944 174.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.44 ' O ' HG13 ' A' ' 36' ' ' ILE . 9.0 tpp180 -79.96 -41.99 24.86 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 122.752 -0.264 . . . . 0.0 110.37 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -56.36 -52.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.472 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.83 -31.24 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.477 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -66.18 -42.14 89.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.998 176.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.1 mt -65.93 -51.4 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.6 mt -57.72 -59.31 3.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.779 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.424 ' OE1' ' HA ' ' A' ' 45' ' ' LYS . 9.9 mt-30 -61.93 -33.74 74.81 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -76.56 -36.28 57.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.592 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -78.47 -31.24 47.79 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.075 0.464 . . . . 0.0 110.024 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.492 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 16.5 mm-40 -116.33 83.26 12.8 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.105 -177.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.89 -15.13 48.84 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.389 2.059 . . . . 0.0 112.456 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -74.52 -19.75 60.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.987 0.422 . . . . 0.0 110.199 177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -95.5 19.01 11.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.424 ' HA ' ' OE1' ' A' ' 38' ' ' GLN . 55.1 tttm -69.98 -9.12 54.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.275 0.56 . . . . 0.0 110.598 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -87.14 11.0 15.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.916 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.5 m -72.81 91.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 46.9 m-80 -62.96 121.76 70.73 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 76.8 Cg_exo -46.99 -34.89 17.47 Favored 'Trans proline' 0 N--CA 1.477 0.526 0 C-N-CA 124.202 3.268 . . . . 0.0 114.977 -170.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.75 -22.44 61.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 111.526 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -140.55 70.65 1.36 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.05 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.4 mt -86.33 121.21 37.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.846 0.355 . . . . 0.0 110.772 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -104.51 126.55 51.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.615 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.411 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.8 mt -103.66 109.79 28.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 120.655 0.264 . . . . 0.0 110.551 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -107.15 99.13 8.7 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.157 0.98 . . . . 0.0 110.626 175.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -68.14 -4.32 13.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.739 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -80.01 -22.66 42.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.602 0.239 . . . . 0.0 110.823 -178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -101.17 -24.42 14.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.782 0.325 . . . . 0.0 110.153 176.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 37.4 mt -59.46 125.2 22.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.071 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.32 149.6 91.56 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.051 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -42.7 -36.43 4.94 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.722 2.281 . . . . 0.0 113.452 174.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 m -56.92 -55.02 39.92 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.411 0.148 . . . . 0.0 111.215 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.407 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.7 m -59.84 -46.11 90.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.208 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.96 -37.32 76.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -73.77 -44.81 54.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.5 -39.83 92.34 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.848 0.356 . . . . 0.0 110.435 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.539 ' O ' HG13 ' A' ' 71' ' ' VAL . 90.8 mt -60.67 -55.79 29.05 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.27 175.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -55.77 -45.9 78.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.341 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.06 -39.09 77.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -77.44 -47.16 20.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.038 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.554 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.6 m -62.72 -36.56 75.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.078 0.466 . . . . 0.0 110.735 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.0 p -72.22 -30.71 65.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.701 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -71.79 -19.97 61.93 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.862 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.492 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 47.6 t -90.95 -51.86 5.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.766 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.561 HD21 HD23 ' A' ' 25' ' ' LEU . 65.5 mt -79.21 -37.96 36.89 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 31.5 mtp180 -79.51 -5.53 55.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.75 -177.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -107.57 -30.91 8.34 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.931 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -140.07 110.81 6.8 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.707 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -74.55 -25.22 59.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.192 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.87 110.47 9.34 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.689 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -47.72 126.26 12.38 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 123.394 2.729 . . . . 0.0 113.384 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -106.85 164.08 12.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.244 177.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.448 -0.787 . . . . 0.0 109.855 178.762 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.439 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.831 -0.063 . . . . 0.0 110.831 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 37.0 tp 55.72 55.11 7.46 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.645 0.736 . . . . 0.0 110.056 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -130.78 85.16 2.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.454 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 10.6 m -70.84 -48.05 56.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 15.8 t -177.48 91.95 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.954 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 68.6 mt -86.44 110.83 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.411 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 44.2 t -92.74 103.34 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.138 -175.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.7 ttmm -93.91 100.83 12.92 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.435 ' CE1' ' HB2' ' B' ' 209' ' ' LYS . 32.1 p90 -105.47 124.1 48.99 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.561 175.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -80.18 94.05 5.96 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.705 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 209' ' ' LYS . . . . . 0.435 ' HB2' ' CE1' ' B' ' 207' ' ' PHE . 56.9 tttm -87.34 129.72 50.36 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.289 -174.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -82.33 171.26 12.62 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.587 2.191 . . . . 0.0 111.566 173.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 95.1 mt -128.72 84.73 62.25 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.939 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -59.77 122.43 11.43 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.486 2.124 . . . . 0.0 111.308 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 91.1 mt -83.07 25.24 0.71 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.097 0.475 . . . . 0.0 111.315 -176.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.1 p -79.78 68.32 5.82 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.862 174.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 61.75 66.32 1.54 Allowed Pre-proline 0 C--O 1.234 0.237 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.76 -174.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -74.18 130.31 14.05 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.584 2.189 . . . . 0.0 112.162 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.285 -1.286 . . . . 0.0 111.201 179.777 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.707 0.289 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -57.91 -40.07 79.45 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -65.36 -54.93 21.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.624 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.19 -23.15 57.64 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.083 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.7 -36.97 83.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.34 0.591 . . . . 0.0 109.786 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.21 -26.38 62.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.072 177.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 61.3 m -87.54 98.47 11.42 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.922 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -73.49 141.67 80.23 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.45 123.66 14.29 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 123.115 2.543 . . . . 0.0 112.016 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.4 mmt -57.63 132.41 53.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.145 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 p -77.75 174.77 10.61 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.47 -45.96 84.21 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 109.919 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -56.41 -44.86 80.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.816 -179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.69 -47.09 79.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.432 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -57.79 -40.4 79.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.277 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.5 ttp-105 -59.97 -45.43 92.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.238 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -61.78 -41.43 97.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.383 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.725 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.11 -41.16 82.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.925 -178.234 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.444 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 98.5 p -63.15 -25.16 68.22 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.526 -0.734 . . . . 0.0 110.592 175.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.9 mt -82.24 -45.28 15.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.633 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.725 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -61.78 -42.25 98.75 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.82 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.425 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.4 mt -59.65 -40.69 82.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.067 0.461 . . . . 0.0 110.656 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -71.33 -20.11 62.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.307 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.7 mtpp -85.15 -14.86 45.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.13 0.491 . . . . 0.0 110.437 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.547 HD11 HG12 ' A' ' 71' ' ' VAL . 92.7 mt -80.03 139.69 53.34 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.189 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.556 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 98.6 Cg_endo -80.61 171.84 14.12 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 123.206 2.604 . . . . 0.0 112.983 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.68 -38.68 64.54 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.622 -0.323 . . . . 0.0 113.33 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 11.1 mp0 -50.53 -56.39 11.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.603 0.716 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.613 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.3 mptp? -78.24 -27.91 47.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.595 -175.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.08 -31.06 64.85 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.745 175.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.39 -40.91 96.68 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.655 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HG2' ' CE1' ' A' ' 70' ' ' TYR . 5.0 tpp180 -73.74 -40.99 63.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.428 0.156 . . . . 0.0 110.8 178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.507 HG13 HD22 ' A' ' 67' ' ' LEU . 60.7 t -56.58 -55.05 21.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.876 0.37 . . . . 0.0 110.65 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 52' ' ' ILE . 7.1 p -65.71 -27.85 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -65.27 -43.64 90.62 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.844 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.25 -42.77 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.145 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.1 mt -62.64 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.767 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -63.66 -32.43 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -173.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -72.58 -38.63 67.84 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.812 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.99 -30.8 56.1 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.93 0.395 . . . . 0.0 110.539 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 31.3 mm-40 -117.9 82.07 16.53 Favored Pre-proline 0 N--CA 1.445 -0.685 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.034 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.5 -8.72 23.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.587 2.191 . . . . 0.0 112.838 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -87.48 -5.08 58.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.136 0.493 . . . . 0.0 110.439 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -105.11 25.56 10.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.148 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -76.72 -10.72 59.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.439 0.638 . . . . 0.0 109.684 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -78.99 0.5 27.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.767 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.2 m -69.78 99.37 1.35 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.253 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 p30 -57.06 124.35 65.09 Favored Pre-proline 0 CA--C 1.517 -0.295 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 173.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.6 Cg_exo -57.63 -11.69 9.64 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.935 2.424 . . . . 0.0 112.172 177.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -84.05 -36.07 23.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.634 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -136.44 65.31 1.52 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.775 0.322 . . . . 0.0 111.536 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 34' ' ' VAL . 18.1 mt -76.49 124.52 34.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.117 0.484 . . . . 0.0 111.438 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -108.82 110.73 22.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.837 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.406 HD12 ' HB ' ' B' ' 205' ' ' VAL . 53.8 mt -82.27 110.42 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.77 0.319 . . . . 0.0 110.383 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.663 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.0 t70 -103.95 99.0 8.76 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -71.97 -8.12 52.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.169 -176.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -84.22 -34.0 23.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.868 0.366 . . . . 0.0 110.792 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 56.6 p -78.15 -31.89 49.99 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.839 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 32.5 mt -58.91 128.48 37.44 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.904 -176.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 13.8 mtmm -72.36 150.97 91.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.871 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.15 -36.75 29.57 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.363 2.042 . . . . 0.0 112.518 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -59.26 -47.27 85.97 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.488 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -63.76 -47.67 80.07 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.173 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 71.6 mt -59.35 -35.26 73.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.086 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.9 tpt180 -72.1 -46.22 57.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.083 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -66.48 -39.71 88.91 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.962 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 89.7 mt -56.96 -57.06 14.18 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.699 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.06 -42.48 76.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.244 177.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 54.1 ttp85 -64.49 -33.45 75.92 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.162 0.506 . . . . 0.0 110.57 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.431 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 71.5 t80 -80.72 -47.17 14.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.782 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.608 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.0 m -62.54 -37.97 80.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.104 0.478 . . . . 0.0 110.637 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.8 p -70.28 -36.7 74.55 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.849 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -62.66 -28.01 69.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.393 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.613 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 44.4 t -89.55 -54.24 4.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.595 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.9 mt -76.1 -35.88 59.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -171.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 54.4 mtp180 -75.73 -5.43 45.66 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.043 -177.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -113.89 -39.42 3.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.741 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -145.31 86.37 1.76 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.125 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -82.67 -5.08 58.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.234 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -109.2 92.98 12.12 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.792 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.409 ' HB3' ' HG3' ' A' ' 26' ' ' PRO . 88.8 Cg_exo -48.81 128.17 18.22 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.18 2.587 . . . . 0.0 113.177 -177.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -85.48 49.43 1.76 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.38 0.61 . . . . 0.0 110.533 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.889 179.039 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.966 0.412 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 25.4 tp -123.38 128.76 50.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -81.08 58.81 3.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.081 0.467 . . . . 0.0 110.851 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 45.9 t -65.37 -70.77 0.22 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.065 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 5.8 t -150.96 72.84 1.08 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.68 97.31 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.922 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.444 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 66.6 t -77.73 134.45 28.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.467 -174.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -111.23 131.76 54.87 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.58 144.63 30.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.129 0.49 . . . . 0.0 110.538 173.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.47 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 56.8 mttm -97.37 120.54 37.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.398 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -100.2 103.88 25.87 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.665 0.269 . . . . 0.0 110.864 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 93.7 Cg_endo -86.14 84.86 1.08 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.726 2.284 . . . . 0.0 111.749 179.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 42.0 tp -85.89 115.14 60.58 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.513 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -65.66 110.14 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.625 2.217 . . . . 0.0 111.885 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 96.7 mt -132.7 26.0 4.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.377 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 214' ' ' THR . . . . . 0.442 ' O ' ' HD3' ' B' ' 216' ' ' PRO . 4.8 m 57.07 51.63 10.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.706 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -109.23 93.79 14.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.374 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 216' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' B' ' 214' ' ' THR . 90.2 Cg_endo -90.35 -173.61 0.67 Allowed 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.78 2.32 . . . . 0.0 112.028 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.193 -1.337 . . . . 0.0 111.535 177.749 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.513 0.197 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -92.88 -24.93 18.3 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.243 -0.286 . . . . 0.0 111.689 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -59.83 -30.83 69.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 0.0 111.089 -174.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.39 -35.29 79.91 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.038 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -87.54 -40.88 13.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.4 0.619 . . . . 0.0 110.227 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -60.76 -38.16 84.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.506 -178.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.545 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 74.8 m -91.75 99.27 12.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.961 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -71.32 144.95 90.08 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.986 0.422 . . . . 0.0 110.637 176.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -61.41 124.83 15.47 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.809 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.512 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -56.64 134.82 54.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.176 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 m -95.68 176.51 6.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -51.55 -54.5 26.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -166.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -48.93 -49.8 38.44 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.264 0.554 . . . . 0.0 110.691 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.94 -46.1 90.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.455 -174.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.512 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.8 mttt -58.01 -42.14 84.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.444 177.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -62.26 -44.76 95.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.334 177.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -63.93 -38.07 89.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.373 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.654 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.62 -39.19 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.756 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.6 p -64.26 -26.24 68.41 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.515 -0.74 . . . . 0.0 110.357 175.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 70.8 mt -81.68 -44.72 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.583 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.654 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.2 p30 -62.85 -41.7 99.47 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.676 178.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 25' ' ' LEU . 94.2 mt -60.26 -41.0 85.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.003 0.43 . . . . 0.0 110.679 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -71.16 -24.18 62.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.245 -177.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 29.1 mtpp -80.31 -22.0 41.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.597 HD11 HG12 ' A' ' 71' ' ' VAL . 92.1 mt -70.27 139.0 86.94 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.489 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.592 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 74.4 Cg_endo -75.15 161.89 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.975 2.45 . . . . 0.0 111.463 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.93 -22.86 58.37 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.337 -0.847 . . . . 0.0 114.003 -170.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -64.42 -52.08 59.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.338 0.589 . . . . 0.0 110.218 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 2.6 mptp? -69.31 -23.76 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.842 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.61 -27.52 69.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.65 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.86 -33.76 84.58 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.881 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.9 tpp180 -81.07 -40.84 23.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.447 0.165 . . . . 0.0 110.812 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.551 HG13 HD22 ' A' ' 67' ' ' LEU . 60.4 t -58.03 -52.05 63.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.918 0.39 . . . . 0.0 110.774 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.96 -30.16 49.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -177.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.53 -41.99 92.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.756 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 32' ' ' ARG . 71.2 mt -64.79 -41.75 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.103 178.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 33' ' ' VAL . 60.9 mt -64.19 -61.5 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.353 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.538 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 28.5 mt-30 -63.17 -30.32 71.49 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -76.48 -36.79 57.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -80.3 -28.2 38.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.662 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 58.5 mm-40 -111.43 81.35 3.04 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.075 176.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.07 -15.07 47.2 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.395 2.063 . . . . 0.0 112.718 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -84.9 -3.79 58.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.146 0.498 . . . . 0.0 110.494 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.59 23.72 14.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.79 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -64.4 -26.23 68.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.206 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -95.61 41.51 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.342 -178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.538 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 68.7 m -80.24 107.16 12.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.455 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 2.9 p30 -55.84 122.78 48.73 Favored Pre-proline 0 C--O 1.228 -0.066 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.63 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -61.18 -9.03 11.39 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.127 2.551 . . . . 0.0 112.648 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.486 ' CG ' ' HG2' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -82.98 -44.36 15.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.928 179.36 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HG2' ' CG ' ' A' ' 50' ' ' ASP . 5.5 mm-40 -133.57 70.53 1.46 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.481 -177.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.4 mt -74.35 116.14 16.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 CA-C-O 121.319 0.58 . . . . 0.0 110.253 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.0 mm-40 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.59 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 47.7 mt -89.63 107.8 18.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 175.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -107.95 98.74 8.27 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.224 1.011 . . . . 0.0 110.76 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -66.78 -7.95 24.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.849 -176.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.94 -20.31 49.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -177.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.6 p -104.5 -29.58 10.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.445 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.463 HD23 ' HG3' ' A' ' 41' ' ' GLU . 36.2 mt -51.28 123.93 10.65 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.365 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 57.4 mttp -67.01 152.56 95.88 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.271 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.65 -40.81 30.93 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.444 2.096 . . . . 0.0 112.998 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 21.9 t -54.64 -50.96 66.87 Favored 'General case' 0 C--N 1.334 -0.107 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -51.05 71.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.43 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' A' ' 59' ' ' LEU . 77.0 mt -56.47 -39.74 73.71 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.168 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 22.7 tpt180 -72.51 -46.75 53.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.344 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.2 mt-10 -68.22 -39.37 82.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.754 0.311 . . . . 0.0 110.718 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.553 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.9 mt -56.88 -55.25 36.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.593 173.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -56.04 -40.27 73.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.138 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -62.24 -43.71 98.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.441 0.639 . . . . 0.0 110.041 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -74.52 -43.89 53.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.716 -174.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.597 HG12 HD11 ' A' ' 25' ' ' LEU . 15.0 m -65.16 -37.63 80.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.993 0.425 . . . . 0.0 110.71 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.405 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 36.7 p -74.43 -35.71 63.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.327 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.7 p -67.27 -19.93 65.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.428 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 18.1 t -91.28 -54.84 3.75 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.626 178.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.541 HD21 HD23 ' A' ' 25' ' ' LEU . 72.3 mt -78.26 -33.86 49.38 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -171.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.405 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 67.5 mtp180 -81.32 0.09 38.68 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.713 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -114.12 -23.63 9.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.704 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -161.79 106.02 1.24 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.145 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -75.75 -16.01 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.96 0.41 . . . . 0.0 110.763 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -120.12 75.95 22.86 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 172.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.407 ' HB3' ' HE3' ' A' ' 29' ' ' LYS . 21.6 Cg_exo -64.72 115.53 3.28 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.948 2.432 . . . . 0.0 112.835 -172.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -95.16 -36.87 11.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.791 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.906 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.984 -179.678 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.58 18.0 19.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.762 0.315 . . . . 0.0 111.193 -178.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -83.68 74.35 10.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.808 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 20.2 m -104.01 -58.1 1.93 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 18.2 p -166.22 63.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.876 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 40.6 mt -70.93 121.58 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.607 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 40.8 t -96.89 109.69 23.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.483 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 20.9 ttmm -95.8 111.05 23.11 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -127.67 144.35 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.613 176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -99.81 122.81 43.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.412 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -113.28 99.82 50.07 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.766 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.405 ' O ' ' HD3' ' B' ' 212' ' ' PRO . 31.6 Cg_exo -59.26 138.85 87.17 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.273 1.982 . . . . 0.0 110.435 172.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 91.3 mt -75.38 115.48 45.75 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-O 120.739 0.304 . . . . 0.0 111.26 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 212' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' B' ' 210' ' ' PRO . 83.4 Cg_endo -87.33 152.6 7.95 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.885 2.39 . . . . 0.0 111.344 175.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 8.4 mp -79.66 126.99 31.64 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 11.0 p -77.86 93.45 4.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 61.21 79.48 0.28 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.583 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -79.65 53.74 4.87 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.051 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.366 -177.434 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.527 0.203 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.72 -31.98 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.532 -175.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.527 ' HG2' ' HB2' ' A' ' 62' ' ' SER . 6.9 tp10 -62.17 -37.19 84.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.023 0.44 . . . . 0.0 110.369 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.15 -24.61 67.45 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.647 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -88.21 -23.73 23.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.001 -177.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.59 -49.22 4.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.726 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.8 m -103.8 100.86 10.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.443 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -72.08 147.01 90.64 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -62.77 123.7 12.78 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.874 2.383 . . . . 0.0 112.012 -176.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.531 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -55.37 136.02 49.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.625 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.7 m -91.75 175.21 6.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -51.76 -57.84 8.12 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -164.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -56.44 -34.12 66.53 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -177.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.36 -45.96 71.41 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.531 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.3 mttt -60.07 -42.12 93.87 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.846 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 16' ' ' ARG . 18.4 ttp85 -62.68 -43.5 98.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.483 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -67.23 -42.08 84.63 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.821 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.34 -50.03 74.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.264 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.422 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.1 p -59.77 -33.77 72.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.211 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.2 mt -71.59 -42.22 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.757 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.546 ' HB3' HD12 ' A' ' 75' ' ' LEU . 67.7 m-20 -62.61 -44.31 96.61 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.548 0.214 . . . . 0.0 111.165 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.417 ' HA ' HD12 ' A' ' 25' ' ' LEU . 96.8 mt -61.22 -34.31 60.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 0.0 111.35 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -82.98 -24.51 32.89 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.043 0.925 . . . . 0.0 108.747 -174.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.858 ' HD2' HD13 ' A' ' 75' ' ' LEU . 19.8 ttmt -73.06 -32.33 64.97 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.786 173.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.716 HD23 HD21 ' A' ' 75' ' ' LEU . 90.0 mt -62.6 142.12 96.77 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 121.153 0.502 . . . . 0.0 111.843 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.5 Cg_endo -82.38 169.56 13.94 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 123.045 2.497 . . . . 0.0 112.874 176.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.6 -46.0 53.83 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 114.482 0.553 . . . . 0.0 114.482 -172.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.424 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 3.2 mp0 -47.27 -56.83 6.02 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.823 0.82 . . . . 0.0 110.989 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.619 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -74.4 -24.88 59.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.814 -174.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 13.9 mt -65.13 -27.41 68.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.266 177.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.24 -34.38 89.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.967 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.467 ' O ' HG13 ' A' ' 36' ' ' ILE . 19.4 tpp180 -77.7 -39.65 44.0 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 67' ' ' LEU . 87.0 t -57.64 -55.24 22.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.024 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 p -63.51 -30.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.898 0.38 . . . . 0.0 110.615 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -63.86 -42.12 97.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.749 176.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.3 mt -66.0 -44.83 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -61.67 -60.55 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.165 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.36 -35.92 74.78 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -79.24 -33.85 43.26 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.98 -26.81 36.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.503 176.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' HD23 ' A' ' 59' ' ' LEU . 61.3 mm-40 -115.72 85.33 13.96 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.762 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -63.51 -13.2 34.91 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.23 1.954 . . . . 0.0 112.424 178.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.7 m -79.85 -10.04 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.001 0.429 . . . . 0.0 110.565 176.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -108.81 29.01 7.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.119 0.485 . . . . 0.0 110.21 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -69.12 -23.75 64.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.335 -175.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -95.55 25.02 4.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.503 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 p -73.25 101.03 3.27 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.398 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 2.7 p30 -56.06 122.48 48.07 Favored Pre-proline 0 C--O 1.227 -0.131 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.452 178.071 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.3 Cg_exo -58.25 -14.37 19.56 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.936 2.424 . . . . 0.0 112.039 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.07 -37.44 29.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.699 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -136.92 59.97 1.67 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.645 0.259 . . . . 0.0 111.442 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.611 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 19.7 mt -70.16 124.02 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.026 0.441 . . . . 0.0 111.496 -175.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' CD ' ' HB2' ' B' ' 206' ' ' LYS . 44.8 mm-40 -109.84 115.25 29.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.629 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 34.5 mt -90.11 109.97 21.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 16.0 p-10 -105.98 99.01 8.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.83 0.824 . . . . 0.0 110.659 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -69.94 -0.26 7.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.699 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.534 ' HG3' ' C ' ' B' ' 200' ' ' LEU . 5.0 mm-40 -87.88 -22.58 24.33 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.219 -175.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 75.4 p -102.18 -32.9 9.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.834 176.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.535 HD23 ' HG3' ' A' ' 41' ' ' GLU . 35.5 mt -48.3 123.03 5.9 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.025 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -65.26 152.04 92.68 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.792 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -48.76 -35.04 29.43 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.435 2.09 . . . . 0.0 112.321 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.527 ' HB2' ' HG2' ' A' ' 3' ' ' GLU . 3.8 t -56.37 -53.04 62.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 176.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -46.54 88.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.718 -178.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.406 HD21 ' HB2' ' A' ' 59' ' ' LEU . 81.9 mt -59.14 -36.18 74.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -76.83 -45.31 29.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.076 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -62.29 -45.51 92.92 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.527 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.4 mt -57.37 -55.41 35.18 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.109 176.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -55.45 -47.99 75.19 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.17 -40.57 81.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.883 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -74.29 -47.57 33.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.641 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.8 m -65.26 -35.34 75.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.81 0.338 . . . . 0.0 110.312 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.498 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 35.6 p -72.88 -39.69 66.21 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.647 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 91.8 p -63.9 -21.77 66.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.729 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.619 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.2 t -90.77 -48.22 7.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.798 0.332 . . . . 0.0 110.316 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.858 HD13 ' HD2' ' A' ' 24' ' ' LYS . 70.6 mt -82.37 -37.09 26.14 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -171.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.498 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 82.6 mtp180 -77.08 -7.41 55.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.076 0.465 . . . . 0.0 110.377 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -102.51 -43.85 5.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.507 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -137.51 102.51 4.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.987 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -63.56 -26.62 68.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.765 0.317 . . . . 0.0 111.259 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -128.15 89.5 49.93 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -67.16 66.68 0.63 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.367 2.711 . . . . 0.0 113.408 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -86.53 -41.94 13.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.729 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.13 -0.938 . . . . 0.0 111.233 178.713 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 200' ' ' LEU . . . . . 0.534 ' C ' ' HG3' ' A' ' 57' ' ' GLU . 57.2 tp -160.98 -49.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.455 0.169 . . . . 0.0 111.048 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -143.11 50.41 1.42 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.547 0.213 . . . . 0.0 111.268 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 46.9 t -60.31 -51.94 67.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.582 176.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 13.6 p -157.59 128.49 6.57 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp -120.83 127.18 75.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.0 110.933 177.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.422 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.3 t -114.92 104.09 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.359 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.611 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.1 ttmm -90.12 109.59 20.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 171.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -124.65 137.84 54.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.411 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 26.4 mtpp -88.76 122.45 32.18 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -97.77 106.67 35.26 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -178.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 15.5 Cg_exo -68.53 108.94 1.94 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.835 2.356 . . . . 0.0 112.372 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.78 -48.07 80.2 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.387 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -79.46 67.86 8.47 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.706 1.604 . . . . 0.0 111.506 173.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.75 -33.27 72.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.095 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 17.9 p -116.57 91.69 3.66 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.064 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.432 ' HB3' ' HD3' ' B' ' 216' ' ' PRO . 63.6 tt0 -63.23 -50.81 73.29 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.619 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 216' ' ' PRO . . . . . 0.432 ' HD3' ' HB3' ' B' ' 215' ' ' GLN . 97.0 Cg_endo -78.39 34.86 0.51 Allowed 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 122.046 1.831 . . . . 0.0 112.273 176.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.969 0 CA-C-O 119.098 -0.834 . . . . 0.0 111.278 -177.659 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 120.646 0.26 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -67.58 -34.15 76.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -173.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -65.04 -44.95 87.39 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.895 0.379 . . . . 0.0 110.513 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -72.17 -40.45 67.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.29 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.49 -56.82 5.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 -177.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -72.6 -38.27 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.776 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m 66.24 99.58 0.05 OUTLIER 'General case' 0 C--O 1.234 0.283 0 O-C-N 123.519 0.512 . . . . 0.0 111.528 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -65.8 147.18 98.88 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.341 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -72.07 140.55 34.71 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.594 2.196 . . . . 0.0 111.252 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.497 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.63 120.2 23.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.297 -177.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.9 p -69.92 179.45 2.26 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.51 -50.81 72.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 121.273 -0.171 . . . . 0.0 110.981 -173.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -56.8 -41.76 78.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.834 0.35 . . . . 0.0 111.073 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.29 -44.96 93.53 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.731 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.9 mttt -62.7 -41.04 98.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.688 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttp85 -64.36 -43.15 95.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 110.107 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -61.24 -41.73 97.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.739 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.774 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.99 -32.6 72.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.103 -176.04 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.6 p -68.38 -26.76 65.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.624 -0.673 . . . . 0.0 109.925 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.7 mt -83.8 -39.18 20.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.691 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.774 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.5 p30 -66.17 -41.1 90.78 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.896 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.8 mt -60.94 -40.31 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 0.0 110.096 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -66.67 -29.07 68.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 48.6 mttp -66.25 -28.65 68.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.107 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.657 HD11 HG12 ' A' ' 71' ' ' VAL . 94.5 mt -76.39 135.84 68.83 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.385 -171.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.481 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 86.7 Cg_endo -81.72 171.94 12.73 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.265 2.643 . . . . 0.0 112.531 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.83 -45.11 61.32 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 114.333 0.493 . . . . 0.0 114.333 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -46.66 -52.69 13.22 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.532 0.682 . . . . 0.0 111.478 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -80.47 -29.24 37.44 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.057 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' B' ' 207' ' ' PHE . 12.9 tp -63.19 -24.28 67.81 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.825 0.345 . . . . 0.0 110.2 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.76 -37.02 94.14 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 111.807 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.481 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.7 tpp180 -75.47 -39.02 59.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.442 HG13 HD22 ' A' ' 67' ' ' LEU . 60.0 t -57.33 -55.01 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.076 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.49 -30.81 51.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.022 0.439 . . . . 0.0 110.482 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -64.29 -41.54 96.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.153 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 32' ' ' ARG . 67.7 mt -63.76 -47.35 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.396 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 33' ' ' VAL . 46.5 mt -63.95 -59.56 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.341 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.58 -31.29 70.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 t -77.99 -39.53 42.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.891 -0.324 . . . . 0.0 111.401 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.06 -28.58 57.68 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.073 0.463 . . . . 0.0 110.447 176.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -116.9 78.98 9.76 Favored Pre-proline 0 N--CA 1.44 -0.929 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.468 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.27 -15.66 49.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.18 1.92 . . . . 0.0 112.391 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.3 t -73.08 -12.72 61.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.133 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.09 23.31 14.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -65.29 -31.6 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.725 0.297 . . . . 0.0 111.262 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -85.65 41.95 0.93 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.255 0.55 . . . . 0.0 110.735 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.0 m -84.5 99.99 11.07 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -52.81 117.01 10.05 Favored Pre-proline 0 CA--C 1.523 -0.093 0 O-C-N 123.75 0.656 . . . . 0.0 110.233 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.97 -31.74 45.0 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.701 2.934 . . . . 0.0 114.222 -172.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -73.87 -27.74 61.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.2 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -141.49 79.18 1.67 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.152 0.501 . . . . 0.0 109.652 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.418 HD12 ' CE1' ' B' ' 207' ' ' PHE . 50.5 mt -89.84 126.55 42.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.501 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 33.9 mm-40 -98.78 123.34 42.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.917 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.4 mt -98.01 108.59 22.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 170.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -108.92 100.8 9.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.141 0.972 . . . . 0.0 110.587 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -70.58 -2.85 15.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.546 -1.206 . . . . 0.0 112.128 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -83.0 -23.29 33.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.0 p -97.98 -26.67 14.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.958 0.409 . . . . 0.0 110.095 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.2 mt -58.75 127.53 32.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.047 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -69.76 147.8 96.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -44.19 -34.82 7.29 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.54 2.16 . . . . 0.0 113.095 173.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.6 m -56.69 -51.71 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.145 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -63.37 -45.65 90.14 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.261 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.7 mt -59.07 -35.09 72.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.717 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -71.54 -51.54 22.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.121 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -57.49 -42.86 83.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.543 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.582 ' O ' HG13 ' A' ' 71' ' ' VAL . 78.8 mt -58.69 -58.96 6.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.6 177.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -57.21 -45.42 83.84 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.765 0.317 . . . . 0.0 111.297 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -58.54 -38.63 78.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.27 0.557 . . . . 0.0 110.612 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -75.59 -47.89 24.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.653 -177.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.676 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.5 m -62.9 -39.85 86.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.069 0.461 . . . . 0.0 110.396 -176.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.6 p -68.67 -30.81 69.58 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.105 -178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 85.6 p -68.96 -23.19 64.11 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.377 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.497 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 45.6 t -92.43 -44.95 8.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.121 0.486 . . . . 0.0 110.542 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.562 HD21 HD23 ' A' ' 25' ' ' LEU . 27.9 mt -83.41 -33.76 25.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.574 -171.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.3 mtp180 -78.31 -1.56 33.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.249 0.547 . . . . 0.0 110.05 176.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -104.97 -34.32 8.05 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.253 172.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -150.6 104.29 3.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.104 176.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.2 ptt180 -66.47 111.13 3.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.265 176.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? 60.72 79.07 0.29 Allowed Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.335 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -70.34 99.82 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.928 2.419 . . . . 0.0 112.47 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -101.66 97.74 8.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.876 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.822 -177.076 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.471 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 96.0 mt -135.19 60.13 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 201' ' ' GLN . . . . . 0.422 ' HB3' HD11 ' B' ' 204' ' ' ILE . 76.6 mt-30 -138.69 72.69 1.41 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.328 -174.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 11.6 t -75.59 -38.35 59.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.015 0.436 . . . . 0.0 109.853 177.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 9.2 p -165.03 130.71 2.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.149 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 204' ' ' ILE . . . . . 0.422 HD11 ' HB3' ' B' ' 201' ' ' GLN . 4.3 mp -125.35 120.53 58.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.199 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 60.4 t -104.05 109.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.136 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.501 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.1 ttmm -99.75 81.9 2.53 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.55 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.5 p90 -93.35 159.19 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.003 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.427 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 25.2 ttmm -110.13 119.95 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.59 107.96 33.79 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 23.4 Cg_exo -64.47 118.97 5.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.74 2.294 . . . . 0.0 111.769 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 61.1 tp -108.73 106.29 58.5 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.637 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.64 56.86 2.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.807 2.338 . . . . 0.0 111.915 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.5 tp -147.97 -57.19 0.23 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.5 p -76.8 -46.7 23.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.627 172.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -120.59 87.45 41.58 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.66 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -48.7 -39.38 38.16 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.395 2.73 . . . . 0.0 113.289 -179.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.788 0 CA-C-O 119.095 -0.836 . . . . 0.0 111.364 178.494 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.3 t . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.949 0.404 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.97 -29.37 70.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.856 -174.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -69.73 -45.97 66.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.462 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -67.79 -26.95 66.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.248 0.547 . . . . 0.0 110.982 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -80.81 -31.64 35.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.051 0.453 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -69.55 -37.67 77.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.72 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.6 ' SG ' ' HB2' ' A' ' 65' ' ' ARG . 52.8 t -151.54 137.27 17.96 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.526 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -85.23 145.31 42.54 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.027 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -64.23 127.45 19.24 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.85 2.367 . . . . 0.0 111.69 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -61.27 128.86 38.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.226 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.6 p -75.0 176.73 6.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -48.23 80.76 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -53.31 -46.84 69.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.364 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.27 -45.23 77.26 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.864 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.9 mttt -56.46 -38.56 71.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.18 175.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -60.93 -45.31 95.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.314 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -62.95 -39.94 96.15 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.591 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.615 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -69.07 -30.64 69.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.202 -178.269 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.532 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 80.9 p -69.71 -30.03 67.56 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.431 -0.793 . . . . 0.0 110.011 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.6 mt -80.25 -39.18 29.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.608 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.615 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.3 p30 -68.0 -42.48 80.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.397 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -59.5 -39.36 79.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.558 177.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -67.16 -30.86 70.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.902 0.382 . . . . 0.0 111.138 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 75' ' ' LEU . 77.4 mttt -62.54 -30.04 71.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.842 175.07 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.682 HD11 HG12 ' A' ' 71' ' ' VAL . 95.9 mt -73.36 139.28 78.44 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.381 -172.217 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.03 170.28 15.34 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.127 2.552 . . . . 0.0 112.866 177.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.79 -46.26 48.49 Favored Glycine 0 C--N 1.333 0.39 0 O-C-N 123.368 0.418 . . . . 0.0 113.649 -174.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.6 mp0 -47.03 -56.87 5.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.265 0.555 . . . . 0.0 110.988 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -27.09 61.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.52 -176.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.2 -25.16 67.64 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.773 0.32 . . . . 0.0 110.547 178.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.38 92.74 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.073 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 32' ' ' ARG . 5.4 tpp180 -76.8 -40.19 48.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.666 0.27 . . . . 0.0 110.537 177.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.451 HG13 HD22 ' A' ' 67' ' ' LEU . 58.0 t -57.75 -54.07 36.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.897 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.31 -29.84 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.573 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.87 -45.29 90.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.644 176.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.7 -47.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.845 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.6 mt -62.63 -58.99 5.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.768 -178.369 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -62.74 -30.98 71.84 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.3 t -70.39 -50.73 35.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.602 0.239 . . . . 0.0 110.895 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -69.29 -30.85 69.02 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.94 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.42 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 15.9 mm-40 -116.97 81.29 12.14 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.649 -178.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.03 -18.38 64.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.4 2.066 . . . . 0.0 113.104 -177.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.7 t -70.42 -27.79 64.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.036 0.446 . . . . 0.0 110.114 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.38 23.27 1.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.833 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -72.03 -13.0 61.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.365 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -85.14 4.8 32.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.286 0.565 . . . . 0.0 110.621 -177.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.4 m -66.86 104.7 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.159 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 123.66 71.89 Favored Pre-proline 0 CA--C 1.52 -0.2 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 173.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.75 -14.28 17.12 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.001 2.468 . . . . 0.0 112.409 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.04 -33.64 22.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.928 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -137.29 68.02 1.42 Allowed 'General case' 0 C--O 1.227 -0.112 0 CA-C-O 120.713 0.292 . . . . 0.0 110.758 -178.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.442 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.9 mt -78.42 122.09 32.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.346 -175.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -102.34 122.13 43.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.558 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.0 mt -93.63 109.0 21.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -105.42 95.51 5.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.14 0.972 . . . . 0.0 110.627 176.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -66.47 -5.27 10.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.28 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -82.23 -27.97 32.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.634 0.254 . . . . 0.0 110.944 -177.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.3 p -93.05 -22.48 19.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.418 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 27.1 mt -59.9 131.8 51.99 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.078 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.42 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 11.8 mtmm -82.79 153.84 67.66 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.119 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.2 -43.94 24.83 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.446 2.097 . . . . 0.0 113.057 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 70.6 m -52.23 -52.0 54.96 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.147 0.279 . . . . 0.0 111.153 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -60.75 -45.68 93.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 64.0 mt -60.9 -36.83 80.27 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.01 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.6 ' HB2' ' SG ' ' A' ' 7' ' ' CYS . 32.1 tpt180 -70.75 -50.33 37.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 177.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 62' ' ' SER . 60.0 mm-40 -59.05 -41.05 86.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.905 0.383 . . . . 0.0 110.225 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 71' ' ' VAL . 80.1 mt -61.91 -58.16 9.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.692 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.48 -45.23 73.16 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.056 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.86 -36.23 80.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.924 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 69.6 t80 -75.78 -49.11 19.06 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.549 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.682 HG12 HD11 ' A' ' 25' ' ' LEU . 13.7 m -62.65 -40.36 88.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.122 0.486 . . . . 0.0 110.537 -175.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.415 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 29.1 p -65.63 -35.14 79.92 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.082 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.9 p -66.0 -24.77 66.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 110.624 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 44.0 t -91.33 -41.99 10.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.743 0.306 . . . . 0.0 110.579 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.546 HD21 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.7 -38.36 13.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -168.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 39.6 mtp180 -73.28 -4.71 34.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.853 0.835 . . . . 0.0 109.227 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -99.93 -47.14 5.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.132 170.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.6 tptt -154.06 108.07 3.0 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.895 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -64.56 -25.12 67.84 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.193 0.52 . . . . 0.0 110.817 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -138.31 89.25 14.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.492 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -52.62 123.08 12.06 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.363 2.709 . . . . 0.0 112.705 -176.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -158.63 99.87 1.59 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.874 -179.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.53 -0.747 . . . . 0.0 110.086 179.058 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.444 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.961 0.41 . . . . 0.0 110.875 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 92.2 mt -77.45 93.84 4.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.872 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -152.84 123.45 7.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 0.0 111.099 -175.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 4.2 p -89.61 -41.89 11.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.028 175.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 33.5 t -165.39 99.27 0.71 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.877 176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp -87.69 105.16 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.794 0.807 . . . . 0.0 111.401 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.532 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 57.7 t -87.8 113.47 25.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.103 -176.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 19.7 ttmm -96.51 113.77 25.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.73 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -125.38 139.73 53.41 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.351 0.596 . . . . 0.0 110.6 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.515 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 62.7 mttm -89.81 122.51 32.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.316 -0.856 . . . . 0.0 108.696 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -97.71 102.39 13.08 Favored Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 52.6 Cg_exo -53.85 106.35 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.332 2.688 . . . . 0.0 112.662 -174.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.9 -51.26 72.53 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -77.29 68.79 7.37 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.0 1.8 . . . . 0.0 112.468 177.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 52.7 tp -78.67 88.6 4.56 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 17.0 m -74.39 -39.05 62.93 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.011 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -130.67 108.63 15.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.435 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.21 60.28 6.25 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.905 2.404 . . . . 0.0 112.096 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.405 -1.219 . . . . 0.0 111.653 179.017 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.947 0.403 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -84.23 -26.61 28.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.077 -178.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.35 -44.89 76.37 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.541 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.52 -20.39 64.59 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.564 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 36.5 t70 -85.02 -19.11 32.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.097 0.475 . . . . 0.0 110.602 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -105.45 -35.1 7.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.097 0.475 . . . . 0.0 110.202 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.478 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 55.7 m -104.94 97.69 7.51 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.339 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.564 ' HE3' ' O ' ' A' ' 5' ' ' ASP . 1.4 mptm? -87.4 143.91 34.98 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.785 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.08 123.31 12.64 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.795 2.33 . . . . 0.0 111.433 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.4 mmt -62.81 130.12 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.634 -176.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.0 m -90.14 177.68 6.37 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -57.64 -54.11 50.58 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -165.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -48.99 -41.26 33.76 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.41 -48.39 70.2 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.694 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 10' ' ' MET . 95.0 mttt -57.58 -40.73 79.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.279 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -63.78 -47.07 82.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.335 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -60.33 -46.11 91.05 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.19 -48.21 82.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.471 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.589 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.7 p -60.81 -32.99 72.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.144 0.497 . . . . 0.0 110.753 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -76.68 -34.93 58.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.547 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.468 ' HB3' HD12 ' A' ' 75' ' ' LEU . 64.0 m-20 -68.91 -41.93 77.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.228 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.16 -35.22 60.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.948 0.404 . . . . 0.0 110.664 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -73.95 -24.88 59.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.764 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.6 mttp -66.33 -42.84 87.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.295 0.569 . . . . 0.0 110.363 172.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD11 HG12 ' A' ' 71' ' ' VAL . 96.1 mt -58.41 136.04 85.45 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.651 -174.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.1 Cg_endo -80.3 172.43 13.7 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.381 2.72 . . . . 0.0 112.88 177.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.46 -46.3 52.86 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 123.328 0.393 . . . . 0.0 114.034 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -48.71 -58.21 5.11 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.208 0.528 . . . . 0.0 111.843 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.575 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.3 mptp? -71.22 -23.91 62.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.964 -175.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -63.63 -26.72 68.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.336 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.63 89.87 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.026 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.405 ' O ' HG13 ' A' ' 36' ' ' ILE . 22.6 tpp180 -78.76 -41.0 31.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.538 0.209 . . . . 0.0 110.578 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 HD22 ' A' ' 67' ' ' LEU . 95.6 t -55.97 -55.53 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.004 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.97 -31.8 53.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.604 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -64.95 -41.09 95.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.884 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.7 mt -64.95 -44.93 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.177 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -62.25 -61.64 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.972 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -61.78 -31.83 72.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -173.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -79.81 -30.93 40.65 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.698 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -83.96 -25.32 30.16 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.227 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.06 81.68 16.6 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.508 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.89 -16.18 53.33 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.694 2.263 . . . . 0.0 113.116 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 m -78.48 -8.4 58.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.013 0.435 . . . . 0.0 110.317 176.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.6 mt -110.07 28.81 8.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.228 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -81.81 -8.33 59.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.469 0.652 . . . . 0.0 110.514 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -103.4 30.46 4.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.708 176.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.0 m -72.48 110.88 7.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.578 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.79 118.6 13.73 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 123.204 0.315 . . . . 0.0 110.202 175.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.99 -13.03 32.61 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.705 2.27 . . . . 0.0 111.109 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 4.3 m-20 -78.29 -37.46 44.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.16 -178.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.11 60.94 1.36 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.502 0.191 . . . . 0.0 110.993 -176.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 16.2 mt -63.21 123.48 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.039 0.447 . . . . 0.0 111.898 -173.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' B' ' 206' ' ' LYS . 41.0 mm-40 -100.7 116.96 33.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.432 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.6 mt -95.35 107.25 19.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 174.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -107.48 98.38 8.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.907 0.861 . . . . 0.0 110.273 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -68.59 -6.07 23.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.867 -1.061 . . . . 0.0 112.162 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -76.8 -31.11 56.75 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.77 0.319 . . . . 0.0 110.84 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 p -93.32 -22.82 18.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.43 131.56 50.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.11 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -74.29 152.8 88.11 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.079 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -49.27 -34.88 32.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.599 2.199 . . . . 0.0 111.939 174.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.5 m -56.79 -52.4 65.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.252 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.18 -47.86 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.616 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.02 -35.3 69.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.15 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.478 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 27.9 tpt180 -73.35 -49.97 24.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.779 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -63.63 -41.51 98.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.782 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.58 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.3 mt -58.33 -55.87 29.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.334 176.162 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -55.81 -47.75 76.62 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.882 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -57.65 -38.15 74.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.097 0.475 . . . . 0.0 110.873 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -75.61 -49.28 18.96 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.589 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.58 HG13 ' O ' ' A' ' 67' ' ' LEU . 6.3 m -63.91 -39.85 86.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.763 0.316 . . . . 0.0 110.27 -175.424 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.6 p -67.04 -35.64 80.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.11 -178.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -67.91 -24.51 65.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.866 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.487 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.1 t -91.96 -26.26 18.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.05 0.452 . . . . 0.0 110.814 -178.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 HD23 ' A' ' 25' ' ' LEU . 31.1 mt -103.45 -44.99 4.98 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -171.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -69.88 -16.09 63.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.63 -13.53 58.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.043 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 79' ' ' ARG . 2.3 tppp? -148.31 -94.48 0.08 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.406 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.418 ' H ' ' HB3' ' A' ' 78' ' ' LYS . 38.1 ptt180 171.41 -47.68 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.531 0.733 . . . . 0.0 109.659 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -154.53 95.53 2.68 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.609 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -73.15 110.8 3.13 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.246 1.964 . . . . 0.0 112.006 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -86.12 65.67 9.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.645 0.736 . . . . 0.0 109.342 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.033 -0.984 . . . . 0.0 109.993 -178.611 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 120.718 0.294 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.63 -24.34 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.921 0.391 . . . . 0.0 111.0 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -120.47 97.26 5.48 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.589 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 6.4 p -88.83 -169.68 2.62 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.386 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 37.6 t -71.92 95.59 1.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.789 0.328 . . . . 0.0 110.602 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 32.4 mm -83.23 130.04 36.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.589 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.4 t -109.64 129.74 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.253 -173.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 53' ' ' GLU . 37.6 ttmt -118.25 117.66 29.72 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.403 ' CE2' HD11 ' A' ' 54' ' ' ILE . 23.2 p90 -133.42 145.08 49.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.252 0.549 . . . . 0.0 111.274 -178.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 55.9 mttp -89.25 128.5 35.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.294 173.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -109.11 107.83 60.1 Favored Pre-proline 0 C--N 1.322 -0.602 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.443 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.37 130.58 27.28 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.671 2.247 . . . . 0.0 111.464 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 80.2 mt 63.42 88.6 0.12 Allowed Pre-proline 0 C--O 1.233 0.187 0 O-C-N 123.751 0.657 . . . . 0.0 110.611 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -59.58 0.44 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.129 2.552 . . . . 0.0 112.291 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 33.1 tp -159.78 52.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 22.8 p -79.81 -68.25 0.69 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.846 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 215' ' ' GLN . . . . . 0.414 ' HA ' ' HD3' ' B' ' 216' ' ' PRO . 28.4 tt0 -146.19 124.83 6.44 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 -177.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 216' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 215' ' ' GLN . 3.7 Cg_exo -77.97 54.31 4.81 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.811 2.34 . . . . 0.0 111.28 173.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -1.28 . . . . 0.0 111.487 -177.431 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 120.581 0.229 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -57.2 -40.22 77.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.779 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -72.97 -37.2 67.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.07 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -76.84 -31.49 56.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.948 0.404 . . . . 0.0 110.612 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.55 -27.37 64.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.531 0.682 . . . . 0.0 109.832 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -74.41 -14.26 60.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.054 177.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 85.3 m -91.77 103.04 15.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.909 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.03 148.34 47.66 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.093 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.18 129.8 28.35 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.0 2.467 . . . . 0.0 112.399 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.45 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -66.31 132.7 48.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.48 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 p -75.44 177.04 6.96 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.3 -47.81 84.45 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.285 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.68 -47.05 70.8 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.345 0.593 . . . . 0.0 109.874 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.26 -46.86 84.88 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.652 -176.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.2 mttt -58.19 -40.01 80.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.154 176.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -63.25 -42.94 99.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.547 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -64.37 -36.06 82.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.943 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.735 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.42 -31.8 69.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.735 178.818 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.529 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 60.4 p -70.0 -25.32 63.55 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.569 -0.707 . . . . 0.0 110.001 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.3 -39.27 17.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.334 -178.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.735 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -67.61 -41.27 84.27 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.804 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -60.17 -38.6 77.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.171 0.51 . . . . 0.0 110.15 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -68.35 -31.15 70.34 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.753 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 47.6 mttp -63.39 -38.87 92.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.024 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.631 HD11 HG12 ' A' ' 71' ' ' VAL . 94.3 mt -64.38 135.17 96.24 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.681 -173.043 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -80.36 172.78 13.21 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.533 2.822 . . . . 0.0 113.012 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.8 -46.93 48.18 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.275 0.47 . . . . 0.0 114.275 -172.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.56 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.1 mp0 -48.74 -52.6 22.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.683 0.754 . . . . 0.0 111.335 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.547 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.5 mptp? -76.4 -24.36 54.07 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.193 -173.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.87 -29.19 68.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.046 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.04 -43.72 99.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.783 176.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.592 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.6 tpm_? -68.47 -42.11 79.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.686 0.279 . . . . 0.0 110.66 177.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.597 HG13 HD22 ' A' ' 67' ' ' LEU . 88.3 t -58.17 -58.03 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.927 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 p -62.45 -29.53 47.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.514 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 66.3 t-80 -69.63 -41.82 75.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.323 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.592 HG13 ' HE ' ' A' ' 32' ' ' ARG . 64.4 mt -61.69 -41.83 91.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 175.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.479 HG23 HD21 ' A' ' 59' ' ' LEU . 72.7 mt -62.7 -60.45 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.002 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -174.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -72.53 -42.89 64.24 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.988 -178.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.27 -35.81 71.5 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.557 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.517 ' HG3' HD23 ' A' ' 59' ' ' LEU . 55.6 mm-40 -114.73 86.14 12.53 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.776 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -64.25 -16.26 54.07 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.233 1.956 . . . . 0.0 112.365 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 m -77.36 -12.27 59.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.923 0.392 . . . . 0.0 110.711 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 61.4 mt -99.99 26.44 6.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.123 0.487 . . . . 0.0 110.498 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -70.52 -15.11 62.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.437 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -81.06 11.82 3.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 m -72.57 94.37 1.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.401 176.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.3 119.36 55.56 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -49.84 -31.33 26.08 Favored 'Trans proline' 0 N--CA 1.476 0.452 0 C-N-CA 123.872 3.048 . . . . 0.0 114.651 -174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -74.61 -28.99 61.13 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.134 -0.227 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -140.3 72.95 1.41 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -175.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 26.8 mt -87.3 126.1 41.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.798 0.332 . . . . 0.0 111.377 -176.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.421 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.8 mm-40 -103.43 116.22 32.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.897 178.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.458 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.0 mt -88.99 108.36 18.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -107.88 100.2 9.59 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 122.135 0.969 . . . . 0.0 110.466 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -67.22 -10.12 47.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.235 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -77.15 -30.21 54.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.098 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.4 p -89.31 -26.58 21.04 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 109.922 177.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 41' ' ' GLU . 39.7 mt -59.0 126.97 29.91 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.822 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.413 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 20.4 mtmm -68.6 151.11 97.43 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.94 -34.76 17.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.522 2.148 . . . . 0.0 112.436 174.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -55.92 -56.21 23.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.495 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -58.87 -46.29 88.14 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.677 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.5 mt -58.57 -35.76 72.89 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.974 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.465 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 31.0 tpt180 -76.39 -47.39 23.42 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.001 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -60.33 -42.65 96.11 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.771 0.32 . . . . 0.0 110.42 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.597 HD22 HG13 ' A' ' 33' ' ' VAL . 80.2 mt -59.49 -58.27 9.36 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.482 175.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -54.38 -47.15 73.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -58.03 -37.45 74.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.206 0.527 . . . . 0.0 110.56 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' SER . 62.8 t80 -74.77 -47.53 30.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.764 -179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.645 HG21 ' CG ' ' A' ' 21' ' ' ASP . 10.7 m -63.42 -40.96 90.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.002 0.43 . . . . 0.0 110.347 -176.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.48 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.3 p -67.59 -31.0 70.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.331 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 70' ' ' TYR . 45.2 t -59.96 -33.66 72.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.397 175.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.498 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.5 t -91.56 -36.13 13.87 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.736 0.303 . . . . 0.0 111.025 -175.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.519 HD21 HD23 ' A' ' 25' ' ' LEU . 21.0 mt -94.17 -29.43 15.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -170.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 72' ' ' THR . 72.2 mtp180 -76.23 -16.42 59.82 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -87.32 -57.6 2.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.133 171.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -129.73 101.07 5.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.893 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -67.73 116.45 8.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.958 0.409 . . . . 0.0 110.624 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 25.8 tptp 56.67 69.65 1.68 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.713 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -57.47 125.8 19.95 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.214 2.609 . . . . 0.0 113.246 -171.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -96.18 168.67 10.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.402 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.301 178.391 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.473 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.64 0.257 . . . . 0.0 111.049 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.61 75.19 9.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 0.0 110.54 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.79 11.06 2.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.314 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 20.6 p -151.53 176.57 11.2 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.838 0.351 . . . . 0.0 111.02 -176.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 22.1 t -73.02 91.49 1.58 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.459 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 50.4 mt -86.1 112.45 22.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.039 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 48.7 t -87.69 104.87 14.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.313 -175.027 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 3.9 ttmp? -91.73 103.98 16.49 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.473 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -116.65 151.57 36.02 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.383 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -103.62 105.53 15.79 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.174 -178.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 209' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . 55.2 tttp -75.35 115.68 47.59 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.325 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 209' ' ' LYS . 16.8 Cg_exo -66.36 123.67 11.47 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.568 2.178 . . . . 0.0 111.841 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 80.9 mt -117.81 79.26 13.1 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.16 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.75 133.96 10.61 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.174 1.916 . . . . 0.0 111.756 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.7 tp -89.73 -51.2 5.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.551 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 214' ' ' THR . . . . . 0.462 ' O ' ' HD3' ' B' ' 216' ' ' PRO . 45.9 m 66.95 114.46 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.694 0.621 . . . . 0.0 111.471 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -83.99 108.03 12.59 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.893 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 216' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' B' ' 214' ' ' THR . 94.3 Cg_endo -90.4 9.99 3.07 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.824 2.349 . . . . 0.0 113.096 -176.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.901 -0.944 . . . . 0.0 111.914 179.902 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.48 0.181 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -99.1 -26.96 14.04 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 122.112 -0.367 . . . . 0.0 111.412 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -46.33 74.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.85 -173.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.463 ' HA ' ' O ' ' A' ' 7' ' ' CYS . 2.2 pm0 -74.08 -15.58 61.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.779 0.323 . . . . 0.0 111.004 -178.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -77.79 -35.69 51.19 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -83.09 -45.44 13.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.915 177.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' A' ' 4' ' ' GLU . 12.3 m -113.09 97.78 6.73 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -83.95 134.08 44.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 121.728 0.775 . . . . 0.0 112.429 -173.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -53.91 129.55 34.76 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 124.069 3.179 . . . . 0.0 112.197 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.5 mmt -66.24 149.19 50.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.725 -175.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 19.1 p -86.06 172.74 10.38 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 171.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.28 -46.29 90.35 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 118.704 0.684 . . . . 0.0 109.314 -178.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -53.67 -48.13 69.76 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.177 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.43 -44.89 92.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.95 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 11' ' ' SER . 45.3 mttp -59.58 -38.81 82.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.651 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.3 ttp-105 -60.07 -42.14 93.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.074 0.464 . . . . 0.0 109.947 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -63.79 -39.21 93.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.468 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.812 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.62 -39.59 73.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.549 -178.533 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.455 ' HB2' HG21 ' B' ' 205' ' ' VAL . 85.7 p -61.45 -29.74 70.14 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.531 -0.731 . . . . 0.0 110.233 174.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 58.6 mt -78.58 -43.22 27.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.637 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.812 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.8 p30 -63.12 -41.32 99.3 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.682 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.9 mt -59.31 -41.05 82.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.68 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -72.09 -21.0 61.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.649 -179.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.5 mtpp -84.94 -13.4 50.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.06 0.457 . . . . 0.0 110.248 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.533 HD23 HD21 ' A' ' 75' ' ' LEU . 96.1 mt -81.73 136.73 47.88 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.978 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.0 Cg_endo -79.25 171.92 15.45 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.278 2.652 . . . . 0.0 112.941 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.86 -44.59 61.33 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 121.456 -0.402 . . . . 0.0 113.694 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -48.52 -52.75 21.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 122.857 0.463 . . . . 0.0 110.809 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -76.46 -28.18 56.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.234 -177.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' HG12 ' A' ' 34' ' ' VAL . 10.8 mt -60.06 -30.25 69.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.877 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.25 -39.81 96.52 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.822 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 36' ' ' ILE . 24.0 tpp180 -72.61 -42.92 63.97 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 177.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.9 t -57.11 -54.78 25.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.836 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 30' ' ' LEU . 12.0 p -65.72 -29.03 45.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.803 -178.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.84 -42.96 94.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.6 mt -64.6 -43.18 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.263 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' VAL . 49.3 mt -63.22 -62.58 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 22.1 mt-30 -60.83 -36.72 79.82 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -68.86 -46.57 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.423 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.38 -35.23 77.39 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.823 0.344 . . . . 0.0 110.663 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 29.3 mm-40 -114.17 85.04 9.8 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.909 -174.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.35 -13.64 40.87 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.225 1.95 . . . . 0.0 111.789 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -79.2 -5.47 54.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 177.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 51.9 mt -108.91 33.18 4.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.237 0.542 . . . . 0.0 109.739 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -68.19 -17.84 64.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.425 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.44 41.85 1.01 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.203 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.8 m -98.67 88.1 3.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.119 0.485 . . . . 0.0 110.644 178.067 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 61.7 m-80 -68.87 124.33 90.02 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.802 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 53.8 Cg_exo -55.43 -21.68 31.09 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.429 2.752 . . . . 0.0 114.275 -174.233 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -72.62 -35.33 67.8 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -144.88 76.56 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.168 -175.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.0 mt -76.02 127.11 37.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.021 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -100.94 129.11 46.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.63 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 32.9 mt -110.23 108.43 25.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.05 102.65 11.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.046 0.927 . . . . 0.0 110.298 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.9 -13.65 61.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.547 -1.206 . . . . 0.0 112.628 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -77.58 -25.58 50.09 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.238 -177.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.5 p -91.49 -23.98 19.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 22.9 mt -59.5 130.2 45.71 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.63 176.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 19.8 mttm -73.24 148.49 88.65 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.541 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.41 -34.1 24.62 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.271 1.981 . . . . 0.0 112.248 174.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.3 t -57.12 -55.16 38.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.245 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -60.32 -47.7 84.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.777 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 mt -60.34 -37.08 79.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.117 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.43 -48.02 65.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.572 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -64.16 -44.65 91.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.519 HD22 HG13 ' A' ' 33' ' ' VAL . 94.1 mt -58.43 -56.08 26.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.352 177.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.48 -43.79 75.87 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.087 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -61.0 -41.91 97.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 0.0 111.043 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -71.82 -47.36 53.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.714 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.548 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.5 m -63.75 -38.72 83.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.158 0.504 . . . . 0.0 110.976 -175.291 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 34.3 p -73.6 -31.61 63.66 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HD2' ' A' ' 77' ' ' LYS . 31.5 t -69.92 -19.41 63.39 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.256 177.112 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.591 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 38.4 t -90.46 -55.71 3.48 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.39 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.533 HD21 HD23 ' A' ' 25' ' ' LEU . 76.4 mt -77.68 -36.07 51.61 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 39.8 mtp180 -82.06 -6.37 59.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.807 -176.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.488 ' HD2' ' O ' ' A' ' 73' ' ' SER . 54.6 mttm -105.87 -20.34 13.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.204 173.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -157.92 99.15 1.67 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.301 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 79' ' ' ARG . 16.0 ptt180 -67.02 -26.37 66.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.64 -173.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -120.69 83.8 36.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.06 0.457 . . . . 0.0 110.125 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -65.64 108.47 1.24 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.834 2.356 . . . . 0.0 112.105 -177.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -92.39 123.45 35.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.287 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.685 -0.674 . . . . 0.0 110.119 177.676 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.496 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.81 0.338 . . . . 0.0 110.691 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 34.4 tp -150.18 -11.96 0.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.051 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 69.85 -59.03 0.51 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.56 0.744 . . . . 0.0 111.003 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 66.0 p -151.76 149.95 29.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -51.31 115.39 1.56 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.875 0.735 . . . . 0.0 111.85 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 34.0 mt -95.18 116.99 38.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.764 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 19' ' ' SER . 60.6 t -85.23 137.01 21.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.406 -173.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.7 mptp? -119.17 132.75 56.0 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -138.89 145.14 39.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.911 0.386 . . . . 0.0 110.236 174.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.453 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 62.8 mttm -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.275 178.251 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -116.18 90.29 28.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.242 -175.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 210' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 2.0 Cg_endo -82.73 39.86 0.89 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 123.301 2.667 . . . . 0.0 112.078 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.453 ' HB2' ' HD3' ' B' ' 212' ' ' PRO . 88.5 mt -90.75 -52.8 0.3 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.925 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 212' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' B' ' 211' ' ' LEU . 73.0 Cg_endo -75.78 -8.1 18.92 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.719 1.612 . . . . 0.0 111.346 173.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 46.0 tp -121.67 98.62 6.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.625 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 10.5 p -84.25 32.81 0.49 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.46 0.647 . . . . 0.0 111.079 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -122.91 94.15 47.65 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.571 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.63 165.77 29.73 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.381 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.972 0 CA-C-O 118.54 -1.144 . . . . 0.0 111.604 178.672 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.865 0.364 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -86.81 -6.34 58.84 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -174.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.8 -53.64 53.11 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -71.7 -13.23 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.677 -177.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.94 -43.08 65.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.478 0.656 . . . . 0.0 109.35 175.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -82.6 -39.97 21.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.046 177.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.4 m -102.03 97.74 8.03 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.358 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -68.95 143.05 94.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.099 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.66 132.39 40.08 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.855 2.37 . . . . 0.0 111.27 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.513 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -65.61 126.52 28.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.267 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 p -72.81 175.13 6.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.516 ' OH ' ' HA ' ' B' ' 202' ' ' SER . 2.0 t80 -59.67 -49.98 75.63 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.655 -174.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -55.59 -41.95 74.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.197 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.57 -45.79 85.51 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.925 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.513 ' HE3' ' O ' ' A' ' 10' ' ' MET . 92.0 mttt -59.94 -42.24 93.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -63.52 -40.29 96.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.376 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -61.33 -41.05 96.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.719 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.87 -33.43 73.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -179.613 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.492 ' HB2' HG22 ' B' ' 205' ' ' VAL . 80.1 p -68.56 -25.97 65.17 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.509 -0.744 . . . . 0.0 110.016 174.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -86.33 -38.15 17.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.416 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.719 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -68.17 -41.15 81.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.667 176.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.59 -37.8 76.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.077 0.465 . . . . 0.0 110.364 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.32 -33.09 73.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.926 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.1 mttp -62.56 -40.06 95.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.333 0.587 . . . . 0.0 110.469 174.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.623 HD23 HD21 ' A' ' 75' ' ' LEU . 91.4 mt -63.97 133.12 95.48 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.117 -175.083 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.526 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 85.3 Cg_endo -81.25 171.47 13.8 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.185 2.59 . . . . 0.0 112.951 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.6 -43.58 46.05 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 114.443 0.537 . . . . 0.0 114.443 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.569 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 1.3 mp0 -51.76 -57.19 9.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.625 0.726 . . . . 0.0 110.797 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -71.68 -25.33 62.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.726 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 30' ' ' LEU . 14.7 mt -64.29 -24.05 67.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.009 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.94 -33.79 88.14 Favored Glycine 0 C--N 1.335 0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.103 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -79.17 -38.85 34.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.697 0.284 . . . . 0.0 110.356 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.482 HG13 HD22 ' A' ' 67' ' ' LEU . 60.3 t -59.29 -53.27 50.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.778 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 p -60.51 -33.45 54.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.993 0.425 . . . . 0.0 110.559 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -65.3 -44.44 87.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.173 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -63.47 -46.27 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.469 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.2 mt -60.33 -65.71 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.892 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.471 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 0.0 OUTLIER -58.35 -33.33 69.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -176.589 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 41.1 t -74.27 -27.72 60.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.729 0.299 . . . . 0.0 111.092 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -89.2 -27.37 20.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.063 0.459 . . . . 0.0 110.472 174.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -119.93 87.05 37.67 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.802 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -66.67 -10.64 28.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.167 1.911 . . . . 0.0 111.869 173.85 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.2 m -85.84 4.44 37.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.8 mt -117.09 47.57 1.47 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 110.588 177.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -90.75 -4.11 56.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.465 0.65 . . . . 0.0 110.037 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -77.66 -13.75 59.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.188 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.471 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.5 m -77.88 86.79 4.1 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.526 176.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -71.24 129.61 88.89 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-N 115.122 -0.944 . . . . 0.0 108.945 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.503 ' HA ' HD11 ' A' ' 52' ' ' ILE . 59.5 Cg_exo -47.58 -25.51 5.46 Favored 'Trans proline' 0 N--CA 1.479 0.675 0 C-N-CA 124.204 3.27 . . . . 0.0 115.083 -174.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -81.69 -23.26 36.95 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.443 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -144.65 77.89 1.55 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.142 0.496 . . . . 0.0 110.173 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.503 HD11 ' HA ' ' A' ' 49' ' ' PRO . 38.9 mt -91.01 129.4 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.437 -175.002 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.577 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 28.0 mm-40 -103.63 138.53 40.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.468 174.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.2 mt -112.81 108.89 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -111.94 99.0 7.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.06 0.933 . . . . 0.0 110.292 174.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -66.19 -12.64 57.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.129 -174.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.82 -26.97 60.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.913 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.3 p -93.38 -26.32 17.31 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.47 132.4 53.87 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.132 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mtmm -81.12 149.75 66.9 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.444 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.82 -41.59 11.82 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.956 2.438 . . . . 0.0 112.867 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -53.05 -54.08 40.7 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.716 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.5 m -61.31 -48.11 82.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.832 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.6 mt -58.01 -35.42 71.23 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.14 0.495 . . . . 0.0 110.976 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.64 -46.09 48.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.783 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -64.78 -42.88 94.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.644 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 71' ' ' VAL . 87.7 mt -57.38 -56.74 17.96 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.568 177.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -55.4 -44.27 76.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.37 -37.77 78.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 110.912 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -78.39 -47.32 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.016 -177.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.61 HG12 HD11 ' A' ' 25' ' ' LEU . 15.4 m -61.46 -41.82 91.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.139 0.495 . . . . 0.0 110.399 -176.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 24.9 p -65.66 -35.72 81.59 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.932 -178.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.9 p -68.49 -23.24 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.853 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.4 t -91.4 -29.54 17.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.87 0.367 . . . . 0.0 110.704 -179.072 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.623 HD21 HD23 ' A' ' 25' ' ' LEU . 34.8 mt -101.64 -37.1 8.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -80.89 -3.21 50.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.264 0.554 . . . . 0.0 110.633 -177.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -104.25 -20.91 13.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.076 170.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -161.22 98.42 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.764 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -60.2 -25.89 65.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.862 0.363 . . . . 0.0 111.726 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -127.58 86.77 57.67 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.57 94.7 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.889 2.393 . . . . 0.0 112.769 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -82.86 -18.2 41.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 109.676 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.91 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.231 175.666 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 . . . . . 0 N--CA 1.484 1.228 0 CA-C-O 120.873 0.368 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -90.32 125.24 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.86 0.362 . . . . 0.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -128.52 91.94 3.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.038 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 202' ' ' SER . . . . . 0.516 ' HA ' ' OH ' ' A' ' 12' ' ' TYR . 19.6 m -88.67 152.67 21.67 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.516 -178.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 34.2 m -72.31 90.92 1.29 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 45.8 mm -78.76 132.88 31.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.903 178.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 3.5 t -95.69 147.74 5.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.002 -177.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.577 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.8 ttmm -139.09 112.77 8.38 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.48 ' CE1' HD12 ' A' ' 52' ' ' ILE . 30.0 p90 -132.51 136.14 46.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.367 0.603 . . . . 0.0 111.017 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -98.94 90.46 4.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.346 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -67.32 132.31 93.27 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.145 -172.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.71 135.79 62.51 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.592 2.195 . . . . 0.0 111.58 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.483 ' H ' HD23 ' B' ' 211' ' ' LEU . 2.5 pt? -70.99 146.34 92.78 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.52 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -72.25 74.14 2.57 Favored 'Trans proline' 0 N--CA 1.465 -0.206 0 C-N-CA 122.607 2.205 . . . . 0.0 111.695 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 4.1 pp -82.24 -12.39 58.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.251 -176.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 35.5 m -105.92 85.7 2.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.194 0.521 . . . . 0.0 110.567 177.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -133.63 100.89 13.32 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.017 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.79 116.56 3.19 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.13 2.553 . . . . 0.0 112.396 -178.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.14 0 CA-C-O 118.182 -1.343 . . . . 0.0 111.282 179.44 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.0 m . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -53.28 -53.41 51.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.89 0.376 . . . . 0.0 111.881 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -79.78 -23.35 42.23 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.631 -172.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.449 ' HA ' ' NH2' ' A' ' 65' ' ' ARG . 33.8 tt0 -73.08 -36.97 66.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.261 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -82.05 -45.83 14.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.125 -178.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -67.42 -53.6 27.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.168 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.57 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 77.2 m 64.84 98.82 0.04 OUTLIER 'General case' 0 C--O 1.235 0.311 0 O-C-N 123.496 0.498 . . . . 0.0 111.694 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -68.83 144.43 95.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.212 173.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.4 130.6 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.841 2.361 . . . . 0.0 111.746 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.589 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 25.8 mmt -65.88 135.39 54.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.878 -175.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 p -84.14 178.33 7.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.883 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.02 -50.02 75.68 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 117.672 0.215 . . . . 0.0 110.646 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -53.95 -41.66 68.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.231 0.539 . . . . 0.0 111.102 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.16 -46.86 69.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.589 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.9 mttt -60.46 -36.99 79.57 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.402 177.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -65.05 -41.82 94.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.683 0.278 . . . . 0.0 110.307 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.97 -42.88 99.16 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.97 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.736 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -67.92 -32.13 72.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.289 -177.832 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB2' HG22 ' B' ' 205' ' ' VAL . 83.1 p -69.53 -26.86 64.72 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 173.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 82.8 mt -82.93 -46.14 13.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.057 -178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.736 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -60.46 -41.86 94.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.848 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HA ' HD12 ' A' ' 25' ' ' LEU . 34.8 mt -61.34 -42.02 92.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.815 0.341 . . . . 0.0 110.682 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -70.19 -25.87 63.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 0.0 111.212 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 52.1 mtpt -78.92 -19.62 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.993 0.425 . . . . 0.0 110.59 178.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.608 HD23 HD21 ' A' ' 75' ' ' LEU . 93.9 mt -75.0 138.64 72.74 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.238 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 97.4 Cg_endo -79.93 172.03 14.58 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 123.238 2.625 . . . . 0.0 112.954 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.2 -44.44 57.51 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.381 -0.438 . . . . 0.0 113.427 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -47.8 -54.27 12.89 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.325 0.583 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.658 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -79.87 -31.89 40.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.996 -175.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 6.2 mt -61.81 -27.16 68.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.595 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.13 -35.91 79.54 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.867 173.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' O ' HG13 ' A' ' 36' ' ' ILE . 18.8 tpp180 -79.24 -44.31 22.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.478 0.18 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.548 HG13 HD22 ' A' ' 67' ' ' LEU . 42.8 t -55.16 -52.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.659 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.28 -31.63 53.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.79 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.0 t60 -69.57 -41.13 76.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.96 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.711 HD13 ' HG3' ' A' ' 66' ' ' GLU . 55.6 mt -64.67 -43.0 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.139 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 33' ' ' VAL . 52.3 mt -62.56 -59.25 4.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.476 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.533 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 31.3 mt-30 -61.69 -31.81 71.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 t -77.02 -47.81 19.64 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.162 -0.336 . . . . 0.0 111.183 -177.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -67.64 -29.99 69.45 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.97 0.414 . . . . 0.0 110.279 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.448 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 33.8 mm-40 -113.32 83.41 6.6 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.096 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -65.52 -15.85 51.38 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.024 1.816 . . . . 0.0 111.287 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.2 m -73.25 -13.87 61.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.55 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 64.0 mt -110.21 27.0 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.097 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -62.1 -32.69 73.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.254 -176.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -88.9 42.88 1.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.153 0.501 . . . . 0.0 110.804 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.533 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.2 m -76.04 92.1 3.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.979 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 27.6 m-80 -52.54 116.99 9.73 Favored Pre-proline 0 CA--C 1.519 -0.223 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.704 177.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.2 Cg_exo -54.85 -30.35 67.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.113 2.542 . . . . 0.0 113.422 -173.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -76.69 -24.15 53.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.143 -178.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -140.28 72.95 1.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.2 mt -87.81 125.73 41.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.936 0.398 . . . . 0.0 111.198 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -106.4 117.53 34.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.43 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 59.4 mt -93.83 109.12 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 173.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -110.64 100.66 9.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.937 0.875 . . . . 0.0 110.629 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -66.98 -6.89 18.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.505 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -81.71 -27.89 33.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.718 0.294 . . . . 0.0 111.209 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.4 -24.38 18.09 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.448 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 36.9 mt -61.04 123.27 17.15 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.618 176.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.8 mptt -69.92 148.21 96.22 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.653 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -44.75 -33.59 7.29 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.507 2.138 . . . . 0.0 113.257 175.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.2 t -60.84 -46.7 89.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.496 0.189 . . . . 0.0 110.726 178.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.5 m -65.38 -48.11 74.02 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.76 -37.85 74.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.832 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.57 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 8.7 tpt180 -71.5 -49.48 40.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.828 178.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.711 ' HG3' HD13 ' A' ' 36' ' ' ILE . 6.8 tp10 -56.28 -48.43 76.63 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.175 0.512 . . . . 0.0 110.164 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 96.1 mt -57.14 -58.24 9.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.312 178.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' VAL . 28.8 tt0 -55.04 -47.85 74.23 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.947 0.403 . . . . 0.0 111.004 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -58.04 -36.34 72.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.63 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -80.06 -46.07 17.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.835 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.576 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.0 m -64.1 -39.41 85.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.14 0.495 . . . . 0.0 110.636 -175.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.583 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 23.9 p -72.14 -34.0 68.2 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.532 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.5 p -67.98 -17.71 64.52 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.204 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.658 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.7 t -91.41 -54.26 3.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.663 177.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.608 HD21 HD23 ' A' ' 25' ' ' LEU . 65.7 mt -77.03 -30.34 55.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -173.19 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.583 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.8 mtp180 -82.09 -5.12 58.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.148 0.499 . . . . 0.0 110.297 177.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -99.46 -42.89 6.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.367 174.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.526 ' HE3' ' HB2' ' A' ' 82' ' ' GLN . 26.7 tptp -141.69 97.42 3.15 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.334 176.306 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.5 ptt180 -72.35 123.1 22.32 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.6 tttt 70.67 111.98 0.03 OUTLIER Pre-proline 0 CA--C 1.532 0.285 0 O-C-N 123.873 0.733 . . . . 0.0 110.356 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.15 136.76 68.85 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.754 2.303 . . . . 0.0 112.545 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLN . . . . . 0.526 ' HB2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 tp60 -88.93 110.22 20.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.412 179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.759 -0.638 . . . . 0.0 110.329 179.139 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 199' ' ' ASN . . . . . 0.596 ' N ' HD21 ' B' ' 199' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 120.46 0.171 . . . . 0.0 110.626 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 89.1 mt 54.23 38.96 30.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.369 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 57.9 tp60 -98.53 121.12 40.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.993 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 10.9 p -65.01 -71.65 0.18 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.192 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 75.7 m -146.37 152.03 38.44 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.409 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 pt -124.83 111.92 29.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.52 178.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 205' ' ' VAL . . . . . 0.456 HG22 ' HB2' ' A' ' 19' ' ' SER . 12.5 t -95.73 117.19 39.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.174 -177.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 26.9 mttm -106.26 89.02 2.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -101.0 137.29 39.56 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.459 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -98.0 116.56 30.47 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.039 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 209' ' ' LYS . . . . . 0.465 ' HE3' HD13 ' B' ' 211' ' ' LEU . 65.7 tttp -93.18 115.45 65.01 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.071 -174.593 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -86.75 109.85 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.693 2.262 . . . . 0.0 112.011 176.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.465 HD13 ' HE3' ' B' ' 209' ' ' LYS . 2.3 pt? -152.28 158.54 33.54 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.56 -67.99 0.07 OUTLIER 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.937 . . . . 0.0 111.853 176.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -176.61 -72.42 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.7 t -124.34 17.61 9.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.402 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 68.73 101.84 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.298 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.729 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.42 58.13 6.19 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.902 2.402 . . . . 0.0 111.944 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.535 -1.147 . . . . 0.0 111.24 178.803 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.8 m . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.909 0.385 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -60.64 -38.43 84.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -64.13 -35.97 82.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.318 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.61 -40.43 92.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.793 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -76.22 -34.32 59.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.628 178.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -61.83 -37.97 86.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.172 0.51 . . . . 0.0 110.655 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.1 m -80.2 100.38 8.27 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.008 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -69.75 146.67 95.87 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.84 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.01 126.24 19.78 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.865 2.377 . . . . 0.0 112.173 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.412 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 24.6 mmt -57.08 134.77 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.703 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 m -88.67 174.77 7.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.51 -54.92 40.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -165.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -51.65 -40.06 59.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.657 0.265 . . . . 0.0 111.695 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.66 -47.33 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.491 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.5 mttt -58.52 -41.96 86.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.943 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 ttp180 -63.48 -46.63 85.29 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.334 177.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -50.92 71.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.412 178.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 95.7 p -58.74 -37.02 75.29 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.975 0.417 . . . . 0.0 110.866 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 98.1 mt -70.3 -40.52 74.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.653 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.546 ' O ' HD11 ' A' ' 75' ' ' LEU . 63.7 m-20 -67.25 -37.2 83.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.28 -40.11 86.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.898 0.38 . . . . 0.0 110.719 176.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -72.23 -28.96 63.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.098 0.475 . . . . 0.0 110.563 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.653 ' HD3' HD13 ' A' ' 75' ' ' LEU . 46.6 mttp -62.13 -39.0 91.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.692 171.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD23 HD21 ' A' ' 75' ' ' LEU . 96.0 mt -64.47 141.43 98.21 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.787 -175.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.4 Cg_endo -82.77 172.08 11.41 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.479 2.786 . . . . 0.0 112.717 178.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.11 -39.41 63.57 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.886 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 6.5 mp0 -48.34 -59.53 3.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.73 0.776 . . . . 0.0 111.171 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.7 mptp? -77.42 -29.32 52.92 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.022 -176.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.6 -29.85 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.801 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.8 -35.06 80.45 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.84 175.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -80.69 -38.92 28.09 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 122.749 -0.266 . . . . 0.0 110.748 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.441 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -55.34 -53.76 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 110.548 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.5 p -63.78 -30.92 51.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.672 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -66.59 -41.26 88.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.101 177.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 66.0 mt -63.08 -43.17 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.048 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.462 HD13 HG23 ' A' ' 54' ' ' ILE . 47.4 mt -64.39 -62.29 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.937 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -60.67 -35.43 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.2 t -74.02 -36.81 64.47 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.264 -176.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 11.0 mpt_? -77.73 -31.84 52.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.271 176.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.439 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 21.0 mm-40 -117.91 86.37 25.04 Favored Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.473 -176.128 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.26 -9.72 24.79 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.299 1.999 . . . . 0.0 112.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.4 m -84.47 -3.87 58.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 110.393 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.8 mt -114.29 29.29 8.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.522 0.677 . . . . 0.0 109.325 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -82.19 -9.96 59.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 -172.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -100.6 24.12 9.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.379 0.609 . . . . 0.0 110.355 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.6 p -77.87 103.35 7.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.337 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -57.61 119.72 35.28 Favored Pre-proline 0 CA--C 1.52 -0.192 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.804 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HA ' HD11 ' A' ' 52' ' ' ILE . 86.4 Cg_exo -51.59 -25.31 19.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 123.546 2.83 . . . . 0.0 113.832 -176.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.595 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 18.5 m-20 -77.67 -28.33 51.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.433 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -143.03 76.64 1.54 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 49' ' ' PRO . 41.9 mt -87.97 129.51 39.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.069 -176.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.421 ' HG3' ' HD3' ' B' ' 206' ' ' LYS . 2.2 mp0 -108.44 123.93 49.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.214 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.462 HG23 HD13 ' A' ' 37' ' ' ILE . 17.9 mt -95.74 108.67 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 175.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 13.0 p-10 -104.06 97.65 7.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.008 0.908 . . . . 0.0 110.852 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -71.57 -0.42 10.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.983 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -84.93 -22.13 29.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.84 0.352 . . . . 0.0 110.582 -178.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.7 p -102.52 -25.02 13.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.978 0.418 . . . . 0.0 110.078 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 37.7 mt -57.06 131.83 51.08 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.784 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -75.89 150.55 83.79 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.32 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -45.8 -41.63 19.82 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 113.31 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.8 p -57.72 -48.11 80.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -62.82 -47.51 83.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.157 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.445 HD21 ' HB2' ' A' ' 59' ' ' LEU . 83.0 mt -57.96 -40.59 80.93 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.987 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -68.36 -46.52 69.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.271 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -68.13 -39.71 82.67 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.065 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 71' ' ' VAL . 82.3 mt -57.04 -54.16 49.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 174.676 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -57.46 -47.72 81.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.514 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -63.76 -27.78 69.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.159 -176.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -79.43 -51.67 9.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.11 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.614 HG13 ' O ' ' A' ' 67' ' ' LEU . 5.3 m -66.79 -36.24 76.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.712 0.291 . . . . 0.0 110.878 -173.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.1 p -72.37 -38.28 68.57 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.638 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.1 p -62.18 -24.19 67.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.443 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 27.7 t -91.03 -49.95 6.13 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.507 -179.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.653 HD13 ' HD3' ' A' ' 24' ' ' LYS . 71.9 mt -83.23 -21.19 33.47 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -172.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 72' ' ' THR . 35.2 mtp180 -85.96 0.54 52.98 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.412 0.625 . . . . 0.0 109.789 175.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -104.96 -39.02 6.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.673 169.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -152.52 95.69 2.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.095 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -69.73 123.79 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt 60.38 81.72 0.24 Allowed Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.749 -174.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.43 81.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.135 2.556 . . . . 0.0 112.971 -177.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -118.47 153.54 33.97 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.396 -0.812 . . . . 0.0 110.465 -179.249 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 8.8 p30 . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 120.829 0.347 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.0 27.49 9.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.347 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -63.54 110.31 1.94 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 173.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 58.3 p -74.26 153.99 39.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.215 0.531 . . . . 0.0 111.929 -172.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 11.2 t -81.66 85.16 6.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 46.8 mm -68.73 128.05 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.182 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.6 t -91.74 109.75 21.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.885 0.374 . . . . 0.0 110.657 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 206' ' ' LYS . . . . . 0.421 ' HD3' ' HG3' ' A' ' 53' ' ' GLU . 8.3 tppt? -99.18 83.56 2.88 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 175.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -99.09 158.29 15.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.116 0.484 . . . . 0.0 110.637 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 208' ' ' LYS . . . . . 0.595 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 44.4 tttp -110.32 114.92 28.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.233 -178.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -91.84 129.55 41.79 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.96 115.86 2.98 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.589 2.193 . . . . 0.0 112.093 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 211' ' ' LEU . . . . . 0.488 HD12 ' HD2' ' B' ' 212' ' ' PRO . 21.3 tp -79.5 133.14 60.16 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.676 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 212' ' ' PRO . . . . . 0.488 ' HD2' HD12 ' B' ' 211' ' ' LEU . 60.5 Cg_endo -72.85 55.45 2.77 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.637 2.225 . . . . 0.0 112.28 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 43.7 tp -104.16 -11.49 17.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.541 0.686 . . . . 0.0 109.284 177.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 14.1 t -154.23 148.04 25.45 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.534 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -132.02 89.78 37.27 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.063 0.459 . . . . 0.0 110.523 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.01 154.14 57.81 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.981 2.454 . . . . 0.0 111.596 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.486 -1.175 . . . . 0.0 111.741 179.987 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.839 0.352 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -75.77 147.09 80.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.653 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.5 146.8 96.71 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.4 2.734 . . . . 0.0 112.906 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.72 129.08 34.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.879 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.0 p -72.55 177.45 4.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 177.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -60.7 -46.74 89.22 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.014 -177.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -54.19 -44.26 71.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.015 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -61.39 -46.77 88.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.464 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.425 ' HE3' ' O ' ' A' ' 10' ' ' MET . 90.7 mttt -62.41 -34.21 76.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.549 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.9 ttp85 -68.42 -40.96 81.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.973 0.416 . . . . 0.0 110.08 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.44 -49.08 79.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.022 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.773 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -63.19 -34.83 78.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.214 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.3 t -63.91 -34.18 77.38 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.048 0.452 . . . . 0.0 110.449 173.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.9 mt -79.26 -41.47 28.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.438 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.773 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.9 p30 -65.77 -42.91 90.24 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.143 178.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.1 mt -59.33 -37.32 68.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -71.34 -23.92 62.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.626 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 51.2 mtpt -83.45 -14.25 52.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.054 0.454 . . . . 0.0 110.281 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG12 ' A' ' 71' ' ' VAL . 92.2 mt -79.76 137.73 54.37 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 95.1 Cg_endo -80.98 172.55 12.92 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 123.183 2.589 . . . . 0.0 113.156 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.84 -44.64 49.34 Favored Glycine 0 CA--C 1.519 0.321 0 O-C-N 123.361 0.413 . . . . 0.0 113.701 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 15.6 mp0 -50.16 -57.84 6.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.394 0.616 . . . . 0.0 111.175 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -74.17 -25.53 59.77 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.182 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.55 -26.89 68.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.124 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -63.66 -36.44 93.34 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.208 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -76.61 -37.57 56.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.267 177.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.499 HG13 HD22 ' A' ' 67' ' ' LEU . 57.4 t -59.09 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.619 177.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.43 HG21 HD13 ' A' ' 52' ' ' ILE . 15.0 p -63.43 -28.72 45.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.533 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -67.46 -42.17 83.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.216 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.69 -46.35 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 33' ' ' VAL . 57.1 mt -60.1 -55.63 22.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.44 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 47' ' ' SER . 4.0 mt-30 -61.38 -40.98 96.32 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.5 t -74.28 -30.21 61.99 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.305 -0.247 . . . . 0.0 111.539 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.414 ' HD3' ' OE2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -82.3 -28.86 31.46 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.544 -0.463 . . . . 0.0 110.313 174.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -116.23 83.34 12.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.716 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.58 -16.01 52.07 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.41 2.074 . . . . 0.0 112.783 -178.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.2 t -74.01 -22.36 59.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 109.952 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.2 mt -96.42 25.98 4.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.395 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -63.12 -25.05 68.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -89.46 36.92 0.85 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.459 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.493 ' HB2' HE21 ' A' ' 38' ' ' GLN . 70.1 m -80.12 88.83 5.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 174.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 90.9 m-20 -62.61 124.5 83.27 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.965 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 89.4 Cg_exo -53.01 -23.09 20.5 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.463 2.775 . . . . 0.0 113.904 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.08 -23.37 48.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -147.66 72.62 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.259 0.224 . . . . 0.0 110.792 -174.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.43 HD13 HG21 ' A' ' 34' ' ' VAL . 23.0 mt -90.95 122.12 42.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.533 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -99.9 140.61 33.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.639 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 49.3 mt -112.54 107.69 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.51 92.66 4.14 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 122.23 1.014 . . . . 0.0 110.103 176.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -61.52 -15.93 42.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.229 -174.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -75.15 -22.32 58.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.495 -174.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -96.9 -26.72 14.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.0 mt -58.61 123.88 17.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.848 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.06 150.64 97.47 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.636 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -46.61 -29.5 7.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.483 2.122 . . . . 0.0 112.542 173.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 t -56.73 -55.36 35.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -63.77 -46.16 86.52 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.414 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -59.17 -37.2 76.77 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.093 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -73.25 -45.08 57.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.973 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 29.9 mt-10 -66.47 -38.29 87.0 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.679 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 71' ' ' VAL . 77.3 mt -60.36 -56.83 16.69 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.363 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 71' ' ' VAL . 18.1 tt0 -55.36 -41.83 73.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -58.43 -36.96 74.43 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.302 0.572 . . . . 0.0 110.534 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -82.77 -45.74 14.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.87 -175.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.586 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.4 m -63.19 -36.01 74.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.04 0.448 . . . . 0.0 110.403 -177.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 30.6 p -71.75 -39.95 69.69 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.335 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -64.82 -21.56 66.81 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.611 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.644 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 29.3 t -91.14 -53.14 4.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.762 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.521 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -79.51 -35.68 39.7 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -171.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 72' ' ' THR . 95.2 mtt180 -67.89 -31.43 71.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.4 tttp . . . . . 0 C--N 1.325 -0.47 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.033 177.381 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.407 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 4.4 t -100.81 149.87 5.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.13 -172.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -134.17 127.89 32.92 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -140.64 151.6 44.73 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.149 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.287 175.629 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.495 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 62.5 m . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 120.963 0.411 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.78 149.79 64.55 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.79 135.63 53.19 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 123.185 2.59 . . . . 0.0 112.42 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -70.04 135.02 48.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.5 p -76.76 176.18 8.71 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -61.86 -46.85 87.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.372 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -54.84 -44.66 74.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.112 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -64.7 -46.23 83.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.186 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -58.03 -44.24 87.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.179 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -63.86 -43.09 97.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.875 0.369 . . . . 0.0 110.275 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -57.62 -47.27 82.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.186 176.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -48.07 83.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.036 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.649 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 59.7 p -60.87 -35.87 77.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.796 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.9 -35.93 67.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.954 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.516 ' O ' HD11 ' A' ' 75' ' ' LEU . 1.1 m-20 -70.05 -42.23 73.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.427 177.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.1 mt -56.72 -38.22 56.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.318 0.58 . . . . 0.0 110.646 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.1 -25.25 64.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.576 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -82.11 -15.75 52.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.057 0.456 . . . . 0.0 110.637 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.473 HD23 HD21 ' A' ' 75' ' ' LEU . 92.1 mt -77.41 134.4 66.5 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.531 -176.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.504 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 92.1 Cg_endo -80.45 171.27 14.97 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 123.042 2.495 . . . . 0.0 113.252 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.3 -46.24 44.15 Favored Glycine 0 CA--C 1.52 0.365 0 O-C-N 123.377 0.423 . . . . 0.0 114.048 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -47.75 -51.99 20.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.09 0.471 . . . . 0.0 111.684 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.56 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -79.64 -30.13 41.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.088 -174.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.48 -27.07 68.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.52 -31.27 79.13 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.058 -0.591 . . . . 0.0 112.177 174.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 36' ' ' ILE . 17.1 tpp180 -81.69 -41.69 20.96 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.799 -0.236 . . . . 0.0 110.377 177.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 80.2 t -56.22 -54.12 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.84 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.1 -31.46 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.582 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.64 -41.68 92.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.867 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.2 mt -64.25 -50.98 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.107 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' VAL . 43.2 mt -56.24 -59.88 2.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.161 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -63.14 -34.4 77.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.8 m -77.69 -33.08 53.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 122.026 -0.421 . . . . 0.0 111.754 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -77.13 -30.12 55.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.093 0.473 . . . . 0.0 109.966 174.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 35.0 mm-40 -115.52 84.23 11.91 Favored Pre-proline 0 N--CA 1.446 -0.665 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.41 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.48 -13.97 40.89 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.398 2.066 . . . . 0.0 112.352 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.2 t -79.56 -11.15 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.134 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.0 mt -105.76 32.29 4.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.434 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -80.99 -1.76 45.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.235 0.54 . . . . 0.0 110.496 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -97.4 17.13 18.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.682 0.754 . . . . 0.0 109.659 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.9 m -75.86 95.74 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.903 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -54.82 122.9 43.31 Favored Pre-proline 0 C--N 1.331 -0.205 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 173.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.19 -16.88 23.41 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.889 2.393 . . . . 0.0 112.459 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -82.55 -36.79 25.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.247 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -131.92 62.02 1.64 Allowed 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.894 -176.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.505 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 24.0 mt -74.0 119.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.173 0.511 . . . . 0.0 111.458 -175.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -103.99 131.37 51.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.342 178.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 39.8 mt -106.87 109.67 28.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.27 101.92 11.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.101 0.953 . . . . 0.0 110.543 176.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.81 -6.9 44.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.312 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.74 -30.54 45.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.767 0.317 . . . . 0.0 110.765 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.5 p -90.16 -26.07 20.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.95 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.45 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 38.4 mt -59.32 127.38 31.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.637 176.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -72.91 148.17 89.21 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.854 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -43.79 -36.2 7.51 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.567 2.178 . . . . 0.0 113.201 175.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.492 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 33.5 t -54.6 -56.96 13.51 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 175.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.401 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.2 m -59.18 -47.8 83.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.456 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 59' ' ' LEU . 87.5 mt -57.18 -40.37 77.21 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.115 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 18.3 tpt180 -71.1 -46.92 60.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.023 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 62' ' ' SER . 41.5 mt-10 -65.61 -38.64 90.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.408 . . . . 0.0 110.458 -177.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.537 ' O ' HG13 ' A' ' 71' ' ' VAL . 93.2 mt -62.0 -55.97 23.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.244 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -53.83 -47.21 71.16 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.484 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 69' ' ' ARG . 35.2 ttp180 -52.7 -42.45 64.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.329 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -79.48 -47.84 14.93 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.832 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.1 m -63.79 -35.33 72.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.955 0.407 . . . . 0.0 110.381 -176.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 40.6 p -75.73 -36.69 59.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.828 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.3 p -66.56 -19.32 65.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.749 0.309 . . . . 0.0 110.601 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.56 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 24.4 t -90.44 -51.1 5.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.609 178.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.516 HD11 ' O ' ' A' ' 21' ' ' ASP . 81.3 mt -79.87 -36.8 36.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -173.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 46.1 mtp180 -79.18 -4.74 51.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.105 0.479 . . . . 0.0 110.711 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.0 tttm . . . . . 0 C--N 1.323 -0.568 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 172.585 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 44.3 mm . . . . . 0 C--O 1.231 0.131 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.649 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 88.8 t -104.88 122.91 58.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.419 -177.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 16.5 ttmm -107.09 117.34 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.507 171.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -127.79 141.88 51.46 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp . . . . . 0 C--N 1.316 -0.879 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.695 -179.349 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.45 -0.461 0 CA-C-O 120.795 0.331 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.03 154.33 60.55 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.609 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.59 128.92 24.77 Favored 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 123.172 2.581 . . . . 0.0 112.14 -176.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -61.34 130.06 44.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.189 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.8 p -73.65 173.88 9.13 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.75 -47.3 86.23 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.725 -174.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -53.7 -41.95 67.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.489 . . . . 0.0 111.081 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -67.56 -46.96 71.19 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.121 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.3 mttt -58.73 -42.22 88.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.259 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -62.0 -44.41 96.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.909 0.385 . . . . 0.0 110.336 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.99 -41.41 78.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.426 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.842 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 1.5 mt -67.0 -36.04 81.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.859 -176.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.4 p -65.74 -29.13 69.61 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.867 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.22 -42.41 31.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.842 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.4 p30 -67.85 -45.67 73.94 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.196 -0.201 . . . . 0.0 110.974 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mt -57.25 -34.21 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.365 0.603 . . . . 0.0 110.17 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -71.39 -29.37 64.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.434 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 55.4 mtpt -78.92 -22.37 45.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.035 0.445 . . . . 0.0 110.568 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 75' ' ' LEU . 86.6 mt -72.51 138.76 80.79 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.521 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 48.9 Cg_endo -83.81 172.63 9.85 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.475 2.783 . . . . 0.0 112.799 178.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.03 -44.38 62.32 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.548 -0.358 . . . . 0.0 113.466 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.3 mp0 -46.52 -52.06 14.14 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.615 0.721 . . . . 0.0 111.31 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.565 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.2 mptp? -83.51 -25.7 30.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.816 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.5 mt -64.07 -27.08 68.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.311 177.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.78 92.08 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.046 -0.597 . . . . 0.0 111.625 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -76.74 -42.86 39.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.561 0.22 . . . . 0.0 110.72 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.55 HG13 HD22 ' A' ' 67' ' ' LEU . 59.9 t -56.12 -52.07 54.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.961 0.41 . . . . 0.0 110.731 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 52' ' ' ILE . 8.0 p -65.14 -32.25 57.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.625 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -63.61 -42.43 98.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 79.3 mt -62.79 -49.06 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.316 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.51 -56.97 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -61.51 -32.97 73.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.9 t -80.16 -37.2 33.89 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.219 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.581 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -72.8 -35.6 67.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 120.972 0.415 . . . . 0.0 110.172 175.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.521 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 25.4 mm-40 -114.12 84.63 9.26 Favored Pre-proline 0 N--CA 1.442 -0.833 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.969 -175.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.2 -13.31 39.32 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.334 2.023 . . . . 0.0 112.33 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.0 m -79.06 -7.2 57.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.238 0.542 . . . . 0.0 110.353 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -110.88 25.62 11.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.32 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.77 -16.13 60.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.912 0.387 . . . . 0.0 110.844 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.72 28.14 1.6 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.86 0.362 . . . . 0.0 111.061 177.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 p -80.05 97.71 6.93 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -57.3 123.93 63.79 Favored Pre-proline 0 CA--C 1.516 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.95 -21.23 25.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 123.075 2.517 . . . . 0.0 113.15 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.61 -22.08 37.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.06 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -143.64 75.41 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.307 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.478 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -92.05 121.81 42.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.648 0.261 . . . . 0.0 111.091 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -104.21 137.34 42.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.737 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 54.2 mt -110.83 109.98 30.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.632 0.253 . . . . 0.0 110.58 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -110.53 98.78 7.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.933 0.873 . . . . 0.0 110.474 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -64.66 -16.36 62.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.582 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -74.16 -27.51 60.87 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.659 -176.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.08 -26.63 17.38 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.921 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.8 mt -56.53 128.64 37.19 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.238 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.521 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 24.0 mttm -70.84 149.23 95.05 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.822 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -46.46 -38.84 21.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.16 1.907 . . . . 0.0 112.35 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.8 m -56.61 -50.45 71.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.992 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.3 m -62.14 -48.22 81.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.395 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.02 -34.96 70.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -73.76 -50.54 20.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.128 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.581 ' OE1' ' HD3' ' A' ' 40' ' ' ARG . 40.9 mt-10 -62.41 -40.76 97.59 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.712 0.292 . . . . 0.0 110.779 -178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.599 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.2 mt -57.1 -60.35 3.73 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.357 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.629 ' OE2' HG23 ' A' ' 72' ' ' THR . 6.1 tp10 -51.92 -52.35 50.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.346 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -55.9 -36.5 67.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.051 0.453 . . . . 0.0 110.941 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.13 -48.19 18.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.845 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -63.55 -36.19 75.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.825 0.345 . . . . 0.0 110.62 -175.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.629 HG23 ' OE2' ' A' ' 68' ' ' GLU . 0.9 OUTLIER -67.74 -39.26 84.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.1 p -65.62 -23.15 66.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.812 0.339 . . . . 0.0 110.573 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.565 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 49.1 t -90.01 -47.11 8.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.973 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 25' ' ' LEU . 74.8 mt -87.8 -44.17 11.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' THR . 90.4 mtt180 -66.83 -26.03 66.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.803 0.335 . . . . 0.0 111.208 -176.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.7 mttp . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.17 178.904 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . 0.438 HD12 ' N ' ' B' ' 204' ' ' ILE . 2.3 mp . . . . . 0 C--O 1.235 0.333 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.33 163.24 2.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.158 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 0.0 OUTLIER -159.24 141.85 14.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.114 169.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -140.93 159.62 41.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.896 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.846 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.8 m . . . . . 0 C--O 1.234 0.28 0 CA-C-O 121.201 0.524 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.12 145.46 99.0 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.916 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -64.75 152.63 81.32 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.901 2.4 . . . . 0.0 112.066 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.3 mmt -85.86 130.51 34.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.519 -178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 p -77.8 178.2 7.57 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 175.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.29 -49.59 77.27 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.728 -174.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.13 -49.63 63.33 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 109.711 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.41 -44.93 96.29 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.842 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -60.38 -41.81 94.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.402 177.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -64.73 -41.54 95.88 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.826 0.346 . . . . 0.0 110.396 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.49 -47.56 81.58 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.556 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -61.91 -41.06 97.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.731 178.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.9 p -63.81 -25.32 68.12 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.211 -0.93 . . . . 0.0 110.449 176.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.9 mt -84.73 -42.99 14.71 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.448 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.603 ' OD1' HG21 ' A' ' 71' ' ' VAL . 1.1 p30 -67.4 -41.36 85.06 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 121.258 -0.177 . . . . 0.0 110.785 177.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -58.43 -40.57 78.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.015 0.436 . . . . 0.0 110.269 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -68.34 -30.92 69.99 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 39.9 mttp -62.07 -35.37 78.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.978 0.418 . . . . 0.0 111.346 173.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.625 HD11 HG12 ' A' ' 71' ' ' VAL . 95.0 mt -68.35 135.79 91.06 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.549 -0.751 . . . . 0.0 112.313 -172.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.2 Cg_endo -80.83 172.09 13.59 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.342 2.695 . . . . 0.0 112.803 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.52 -43.46 52.69 Favored Glycine 0 C--O 1.237 0.332 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.378 -175.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 5.5 mp0 -48.62 -55.87 10.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.522 0.677 . . . . 0.0 111.148 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.584 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -80.37 -27.06 38.3 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.445 -174.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.0 mt -62.64 -27.75 69.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.626 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.574 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 36' ' ' ILE . 12.6 tpp180 -66.24 -41.52 89.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.671 0.272 . . . . 0.0 110.675 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 67' ' ' LEU . 93.7 t -56.85 -52.14 58.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.88 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 30' ' ' LEU . 22.2 t -64.17 -36.84 78.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.455 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -59.45 -41.63 90.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.206 177.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.1 mt -66.73 -48.69 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.24 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 33' ' ' VAL . 55.0 mt -58.88 -55.83 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.036 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 37.2 mt-30 -62.3 -34.1 75.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.3 t -78.28 -36.13 47.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -176.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.62 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 5.9 mpt_? -80.32 -27.88 38.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.424 177.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.635 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 60.0 mm-40 -114.21 87.05 12.66 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.851 178.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.12 -13.1 35.79 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.125 1.883 . . . . 0.0 112.109 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.9 t -72.7 -20.95 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.232 0.539 . . . . 0.0 109.803 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.1 mt -104.1 33.82 3.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.228 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -72.74 -17.65 61.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.505 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.71 41.86 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.778 0.799 . . . . 0.0 110.062 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.9 m -88.51 91.01 8.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.424 177.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 87.2 m-20 -60.04 123.22 71.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.19 177.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 59.4 Cg_exo -56.24 -19.04 26.09 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.253 2.635 . . . . 0.0 113.147 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.19 -27.82 38.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -146.85 78.67 1.5 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.921 -176.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 23.2 mt -92.25 125.74 44.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.205 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -104.55 119.63 39.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.651 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.446 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 48.2 mt -96.87 109.42 23.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.238 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 17.0 p-10 -109.39 98.62 7.99 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.931 0.872 . . . . 0.0 110.078 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -68.89 -0.35 5.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.802 -175.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -85.6 -24.69 27.06 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.95 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.2 p -101.78 -26.01 13.62 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.529 HD23 ' HG3' ' A' ' 41' ' ' GLU . 31.3 mt -53.8 128.78 31.2 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.647 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.635 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 23.1 mttm -71.91 150.99 92.97 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.657 178.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -47.11 -36.5 21.43 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.296 1.997 . . . . 0.0 112.426 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 25.6 t -54.4 -54.43 40.73 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.0 -49.62 76.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.668 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -57.38 -37.64 72.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.306 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.6 -45.97 23.55 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.085 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.7 mt-10 -63.92 -36.66 84.67 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.789 0.328 . . . . 0.0 110.457 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.538 HD22 HG13 ' A' ' 33' ' ' VAL . 83.6 mt -62.2 -56.1 22.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.116 174.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.16 -46.83 75.76 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.144 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -63.03 -31.93 73.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.795 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -78.53 -47.78 16.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.612 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.625 HG12 HD11 ' A' ' 25' ' ' LEU . 15.7 m -63.12 -42.47 96.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.14 0.495 . . . . 0.0 110.471 -176.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.404 ' N ' HG23 ' A' ' 71' ' ' VAL . 24.7 p -63.91 -36.66 84.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.933 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 82.9 p -67.73 -24.23 65.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.584 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.3 t -91.14 -32.35 15.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.433 -177.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.601 HD21 HD23 ' A' ' 25' ' ' LEU . 28.1 mt -97.79 -43.05 7.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.404 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 20.9 mtp180 -71.46 -10.7 60.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 110.377 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.283 176.284 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . 0.415 HD12 ' N ' ' B' ' 204' ' ' ILE . 4.0 mp . . . . . 0 CA--C 1.521 -0.16 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.446 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 26.9 t -104.9 105.31 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.337 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.2 ttmm -96.01 118.02 31.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.456 ' CZ ' HD22 ' A' ' 30' ' ' LEU . 10.3 p90 -131.75 137.32 48.15 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.67 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 59.0 mttm . . . . . 0 C--N 1.317 -0.808 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.438 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 m . . . . . 0 N--CA 1.454 -0.253 0 CA-C-O 120.942 0.401 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -75.94 145.19 77.25 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.584 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.9 124.34 13.41 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.494 2.129 . . . . 0.0 110.962 176.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.495 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.2 mmt -57.6 128.7 38.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 p -73.07 175.61 6.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.892 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.311 -174.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -56.3 -40.18 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.158 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.11 -46.4 81.16 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.719 178.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.0 mttt -60.98 -39.56 90.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.394 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -64.2 -44.74 91.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.38 -44.24 88.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.829 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.93 -39.89 79.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.819 -176.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.49 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 87.5 p -63.48 -25.77 68.41 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.715 -0.615 . . . . 0.0 110.328 175.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.2 mt -82.69 -44.76 15.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.164 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.829 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.6 p30 -62.09 -41.19 97.94 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.409 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.437 ' HA ' HD12 ' A' ' 25' ' ' LEU . 84.6 mt -62.94 -40.11 87.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.907 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -68.42 -28.5 67.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.962 0.411 . . . . 0.0 111.213 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.5 mtpp -78.25 -16.88 57.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 84.5 mt -79.3 132.56 62.35 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.619 -176.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 78.3 Cg_endo -76.69 172.18 16.68 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 123.199 2.599 . . . . 0.0 113.085 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.03 -45.54 50.98 Favored Glycine 0 C--N 1.334 0.442 0 O-C-N 123.301 0.376 . . . . 0.0 113.927 -172.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -49.79 -55.31 14.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.415 0.626 . . . . 0.0 110.993 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.9 mptp? -76.5 -31.43 57.71 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.944 -174.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mt -58.39 -31.05 67.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.489 175.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.25 -34.53 89.48 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.268 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -79.03 -39.91 32.79 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.584 0.23 . . . . 0.0 110.499 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.542 HG13 HD22 ' A' ' 67' ' ' LEU . 93.3 t -56.18 -55.09 20.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.685 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.544 HG21 HD13 ' A' ' 52' ' ' ILE . 12.0 p -63.63 -30.77 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.638 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -65.26 -41.77 93.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.908 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.8 mt -65.99 -41.22 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.903 177.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.527 HG23 HD21 ' A' ' 59' ' ' LEU . 72.8 mt -62.41 -60.56 2.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.218 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -65.83 -29.67 70.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -78.28 -38.79 41.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.05 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.462 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 9.6 mpt_? -76.4 -31.92 58.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.577 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.633 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 49.4 mm-40 -112.72 85.26 7.35 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.441 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.76 -12.26 30.71 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.363 2.042 . . . . 0.0 112.567 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -82.29 -5.27 58.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 0.0 110.574 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.5 mt -115.63 27.42 9.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.02 177.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -80.3 -17.14 52.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.252 0.549 . . . . 0.0 110.476 -174.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -92.85 20.66 6.34 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.807 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 66.8 m -68.78 105.26 2.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.177 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.644 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -50.6 120.86 13.57 Favored Pre-proline 0 N--CA 1.463 0.187 0 O-C-N 123.118 0.262 . . . . 0.0 110.534 171.576 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.7 Cg_exo -59.08 -23.08 67.25 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.787 2.325 . . . . 0.0 111.556 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 21.9 m-20 -71.77 -35.96 70.21 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.643 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB2' ' OD1' ' A' ' 48' ' ' ASN . 20.5 mm-40 -138.64 72.1 1.4 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.035 0.379 . . . . 0.0 111.041 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.544 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -82.79 120.7 34.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.009 0.433 . . . . 0.0 111.136 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 19.0 mm-40 -100.84 122.69 43.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.053 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.5 mt -91.04 108.76 20.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.952 175.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -107.19 98.85 8.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.163 0.982 . . . . 0.0 110.309 177.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HD1' ' CD2' ' A' ' 64' ' ' LEU . 93.5 m-85 -70.67 -1.04 10.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.137 -174.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -84.35 -29.28 26.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.932 0.396 . . . . 0.0 110.765 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.6 p -90.7 -32.21 16.27 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' A' ' 41' ' ' GLU . 33.3 mt -53.18 126.98 22.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.118 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.633 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 27.5 mttm -66.03 147.58 98.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.5 -30.44 21.19 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.362 2.042 . . . . 0.0 111.762 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.482 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 13.6 m -60.51 -52.23 66.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 174.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -61.13 -46.46 90.47 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.461 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.4 ' CD2' ' HD1' ' A' ' 56' ' ' PHE . 78.6 mt -58.87 -39.18 80.62 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.843 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -68.23 -48.24 65.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.075 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 62' ' ' SER . 17.3 mm-40 -66.48 -40.72 89.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.853 -178.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.542 HD22 HG13 ' A' ' 33' ' ' VAL . 75.6 mt -57.15 -55.39 35.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.682 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -54.08 -42.4 69.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.91 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -59.86 -43.03 94.92 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.326 0.584 . . . . 0.0 110.167 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -74.88 -46.55 35.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.969 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.572 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.2 m -63.9 -38.1 81.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.074 0.464 . . . . 0.0 110.727 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.7 p -72.8 -38.44 67.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.056 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.2 p -64.84 -19.57 65.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 31.4 t -90.84 -54.83 3.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.65 177.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -78.85 -27.46 44.16 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 57.1 mtp180 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.621 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 tttt . . . . . 0 C--N 1.324 -0.512 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 172.773 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 10.6 pt . . . . . 0 C--O 1.234 0.273 0 CA-C-O 120.931 0.396 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.49 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 61.3 t -121.12 113.82 41.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.633 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.496 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 19.5 ttmm -92.67 116.65 29.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -129.57 143.31 50.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.245 0.545 . . . . 0.0 110.55 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 44.1 mttp . . . . . 0 C--N 1.318 -0.776 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.355 176.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.7 m . . . . . 0 C--O 1.236 0.352 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.56 144.41 97.69 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 170.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.9 129.57 21.12 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.78 2.32 . . . . 0.0 110.993 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.541 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -64.67 128.14 34.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.567 -177.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.4 p -73.53 174.45 8.23 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.7 -46.7 88.28 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.475 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.84 -44.23 77.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.368 . . . . 0.0 111.042 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -63.32 -46.09 88.29 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.913 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.6 mttt -61.25 -39.26 89.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.497 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.8 ttp180 -62.91 -43.62 98.29 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -56.75 -46.13 81.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.167 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.565 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -65.65 -33.17 75.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.464 -175.116 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.4 p -70.1 -27.16 64.37 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.51 -0.744 . . . . 0.0 109.986 175.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 85.8 mt -80.91 -46.01 15.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.201 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.587 ' CG ' HG21 ' A' ' 71' ' ' VAL . 1.3 p30 -65.44 -42.27 92.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.21 -0.196 . . . . 0.0 111.302 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' A' ' 25' ' ' LEU . 35.1 mt -60.37 -41.5 87.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.016 0.436 . . . . 0.0 110.493 176.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -65.14 -24.12 67.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.585 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.6 mtpp -85.89 -7.63 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.476 HD11 HG12 ' A' ' 71' ' ' VAL . 80.4 mt -86.23 137.67 34.78 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.571 -177.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -80.32 167.31 19.56 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.259 2.639 . . . . 0.0 112.841 177.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.01 -46.1 41.72 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 114.39 0.516 . . . . 0.0 114.39 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -53.67 -51.28 63.69 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.451 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.755 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -73.19 -32.73 64.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.642 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.553 HD21 ' CD1' ' B' ' 207' ' ' PHE . 10.6 tp -62.59 -24.63 67.66 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.65 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.87 99.51 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.909 -0.662 . . . . 0.0 111.493 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.1 tpm_? -67.85 -40.99 83.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.533 HG13 HD22 ' A' ' 67' ' ' LEU . 61.2 t -59.0 -58.15 8.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.008 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.13 -27.65 42.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.796 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -68.29 -41.96 80.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.301 -0.409 . . . . 0.0 109.964 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.58 HG13 ' HE ' ' A' ' 32' ' ' ARG . 61.8 mt -62.11 -43.47 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 120.974 0.416 . . . . 0.0 110.31 177.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.487 HG12 HD11 ' A' ' 67' ' ' LEU . 53.2 mt -65.02 -58.5 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.402 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 25.0 mt-30 -63.07 -28.47 70.11 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -173.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -89.95 -27.74 19.61 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.489 -0.484 . . . . 0.0 112.123 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 40' ' ' ARG . 5.0 mpt_? -81.89 -22.94 36.59 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.355 171.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -125.0 65.12 46.39 Favored Pre-proline 0 N--CA 1.442 -0.867 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.936 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -52.47 -17.93 7.4 Favored 'Trans proline' 0 N--CA 1.478 0.601 0 C-N-CA 122.971 2.447 . . . . 0.0 113.284 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.4 m -66.3 -21.85 66.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.963 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.59 41.95 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.036 0.446 . . . . 0.0 110.306 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -73.56 -15.55 61.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.154 -174.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -96.52 35.1 1.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.875 0.369 . . . . 0.0 111.213 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 50.2 m -81.33 89.38 6.08 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 175.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.441 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 86.3 m-20 -61.35 123.44 76.23 Favored Pre-proline 0 CA--C 1.52 -0.209 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.126 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 71.1 Cg_exo -53.17 -21.74 17.68 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.654 2.903 . . . . 0.0 114.268 -174.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 4.6 p-10 -76.11 -36.3 58.92 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.875 -177.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -143.7 77.5 1.56 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.449 HD12 ' CE1' ' B' ' 207' ' ' PHE . 26.2 mt -85.84 128.42 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.214 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -101.15 117.87 35.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 52.8 mt -90.38 108.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' B' ' 204' ' ' ILE . 12.2 t70 -105.11 99.15 8.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -68.18 -13.37 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.547 -172.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -79.38 -35.26 41.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.789 0.328 . . . . 0.0 110.559 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.4 p -80.91 -21.89 40.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.994 176.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 25.0 mt -67.16 135.62 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.494 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -76.54 147.45 78.64 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.005 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -42.94 -40.46 8.45 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.929 2.42 . . . . 0.0 113.05 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -58.13 -50.22 74.25 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.036 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -47.91 83.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.263 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.82 -37.56 71.37 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.023 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -70.63 -52.11 23.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.174 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -62.99 -39.34 94.44 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 111.059 -177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.533 HD22 HG13 ' A' ' 33' ' ' VAL . 85.9 mt -60.24 -57.97 10.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.682 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.513 ' HA ' HG22 ' A' ' 71' ' ' VAL . 7.9 tt0 -58.77 -45.79 88.99 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.726 0.298 . . . . 0.0 111.155 -178.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -57.67 -30.15 65.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.259 0.552 . . . . 0.0 110.295 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 65.1 t80 -82.88 -49.2 9.91 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.919 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.587 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.0 m -60.81 -36.18 69.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.239 0.543 . . . . 0.0 110.482 -176.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.494 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 22.3 p -69.95 -39.91 75.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 92.4 p -65.63 -20.07 66.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.795 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.755 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.5 t -90.76 -53.49 4.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.762 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.47 HD21 HD23 ' A' ' 25' ' ' LEU . 71.1 mt -77.28 -36.0 54.66 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -172.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 72' ' ' THR . 98.3 mtt180 -75.33 -7.62 54.46 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.249 0.547 . . . . 0.0 110.472 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 57.7 tttp . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.166 176.358 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 55' ' ' ASP . 39.3 mm . . . . . 0 C--O 1.232 0.165 0 CA-C-O 120.954 0.407 . . . . 0.0 110.093 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.442 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 58.2 t -85.27 117.73 30.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.328 -174.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -105.63 77.95 1.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.605 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.553 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.0 p90 -92.01 158.16 16.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.217 0.532 . . . . 0.0 110.478 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 12.4 mptt . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.624 179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.7 m . . . . . 0 N--CA 1.45 -0.433 0 CA-C-O 120.903 0.382 . . . . 0.0 110.392 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -75.75 144.78 77.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.34 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.51 135.93 51.97 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.847 2.365 . . . . 0.0 111.534 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -72.66 131.29 42.22 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.826 -175.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 p -76.06 176.71 7.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.782 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.33 -47.88 84.12 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.597 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -53.09 -47.61 68.42 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.399 0.618 . . . . 0.0 110.024 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -63.86 -45.03 91.29 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.963 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 96.2 mttt -59.2 -44.6 92.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.396 175.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.475 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 50.0 ttp85 -59.48 -47.62 84.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.163 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -58.85 -51.94 67.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.968 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.68 -49.82 67.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.827 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 93.5 p -62.57 -30.81 71.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.918 0.389 . . . . 0.0 111.076 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 94.0 mt -73.55 -41.98 62.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.798 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 23.0 m-20 -67.26 -41.51 85.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.291 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' HD12 ' A' ' 25' ' ' LEU . 95.6 mt -58.1 -41.83 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -66.65 -27.59 67.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.532 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.92 -24.82 43.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.061 0.458 . . . . 0.0 110.451 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 75' ' ' LEU . 93.1 mt -66.67 135.49 94.46 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.398 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.8 Cg_endo -80.49 170.08 16.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.951 2.434 . . . . 0.0 112.858 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.59 -44.0 46.35 Favored Glycine 0 CA--C 1.519 0.329 0 O-C-N 123.195 0.309 . . . . 0.0 113.327 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.3 mp0 -45.43 -54.09 7.83 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.5 0.667 . . . . 0.0 111.203 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.665 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -82.71 -29.42 29.84 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.91 -175.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.74 -27.64 68.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.443 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.3 -28.85 71.6 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.139 174.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.464 ' O ' HG13 ' A' ' 36' ' ' ILE . 14.5 tpp180 -84.31 -43.04 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 122.585 -0.362 . . . . 0.0 110.335 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 43.4 t -55.07 -54.16 26.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.49 -29.86 48.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.526 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -66.01 -39.86 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.638 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.5 mt -66.93 -49.97 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.949 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' VAL . 50.0 mt -56.95 -59.73 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.089 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -62.48 -32.46 73.36 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.9 t -80.24 -32.57 38.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -82.58 -25.13 33.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 121.92 -0.488 . . . . 0.0 110.21 175.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.8 mm-40 -117.58 82.08 15.31 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.523 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.11 -15.11 45.91 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.584 2.189 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.9 t -78.31 -24.26 46.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 109.761 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.55 17.94 5.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.199 0.523 . . . . 0.0 110.22 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -74.0 -10.73 59.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.476 0.655 . . . . 0.0 109.683 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -84.22 4.93 28.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.257 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.0 m -67.48 97.84 0.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.299 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 89.8 m-20 -60.34 122.81 69.93 Favored Pre-proline 0 N--CA 1.452 -0.354 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 79.0 Cg_exo -52.09 -26.03 24.6 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.664 2.909 . . . . 0.0 113.451 -174.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -71.01 -29.68 65.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.186 -177.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -143.65 76.07 1.5 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.944 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.7 mt -88.4 126.91 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -108.1 132.55 53.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.775 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.0 mt -104.02 108.84 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 174.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -110.87 97.27 6.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.923 0.868 . . . . 0.0 110.601 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -68.12 -9.27 45.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.937 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 -79.95 -21.4 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.472 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.5 p -99.02 -25.24 14.62 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.47 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 23.3 mt -57.9 130.42 46.45 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.388 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -74.32 148.18 85.89 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.93 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -48.1 -33.93 22.31 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.75 2.3 . . . . 0.0 112.398 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.6 m -57.82 -53.32 59.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.46 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -62.33 -48.45 79.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.739 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.24 -36.68 71.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -69.44 -50.24 47.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.816 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.35 -38.94 91.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.548 ' O ' HG13 ' A' ' 71' ' ' VAL . 85.1 mt -61.22 -56.03 25.26 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.342 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -55.14 -49.77 70.96 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.802 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -55.68 -38.34 69.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.674 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -75.85 -50.08 16.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.726 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.548 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -62.82 -35.79 72.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 -175.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.511 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.7 p -74.61 -38.46 62.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.663 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.6 p -64.99 -19.43 65.99 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.559 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.665 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.4 t -91.02 -55.02 3.71 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.74 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 25' ' ' LEU . 75.1 mt -74.28 -34.5 63.57 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -174.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 72' ' ' THR . 28.2 mtp180 -80.07 8.77 6.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.276 0.56 . . . . 0.0 110.226 177.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.9 tttt . . . . . 0 C--N 1.325 -0.464 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.856 171.776 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 19.8 mm . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 121.403 0.62 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.427 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 39.6 t -82.36 133.93 28.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.842 -175.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -116.65 119.9 36.97 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -129.86 137.88 50.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.155 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 68.3 mttm . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.952 -179.679 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.3 m . . . . . 0 C--O 1.237 0.398 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -72.36 144.32 86.64 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.046 173.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -66.36 124.23 12.22 Favored 'Trans proline' 0 C--O 1.236 0.383 0 C-N-CA 122.801 2.334 . . . . 0.0 111.667 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -58.75 125.76 24.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.904 -176.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 p -72.49 175.22 6.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.15 -49.24 78.63 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.874 0.306 . . . . 0.0 110.356 -175.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -55.12 -41.74 72.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.08 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.85 -46.02 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.938 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.67 -42.89 89.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.416 176.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -63.95 -43.5 95.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.298 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -58.85 -43.06 90.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.369 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -65.64 -38.4 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.275 -177.44 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.8 p -64.55 -28.13 69.43 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 119.979 -0.689 . . . . 0.0 110.093 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.59 -41.21 19.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.459 -178.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.687 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -67.47 -40.87 85.32 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.682 177.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.7 mt -58.78 -40.07 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.093 0.473 . . . . 0.0 110.197 175.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -69.87 -29.4 66.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.824 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 47.2 mttp -64.13 -34.18 77.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.247 0.546 . . . . 0.0 110.966 173.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.671 HD11 HG12 ' A' ' 71' ' ' VAL . 95.4 mt -69.26 131.0 90.61 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.214 -172.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -77.54 172.9 15.04 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 123.525 2.817 . . . . 0.0 112.431 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.33 -45.94 52.38 Favored Glycine 0 CA--C 1.518 0.266 0 O-C-N 123.324 0.39 . . . . 0.0 113.846 -172.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.534 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 9.0 mp0 -47.26 -52.47 15.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.643 0.735 . . . . 0.0 111.034 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.577 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 2.1 mptp? -78.36 -23.8 46.72 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.155 -173.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.462 ' HA ' HD23 ' A' ' 30' ' ' LEU . 11.4 mt -62.11 -27.37 68.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.124 177.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.29 -35.99 92.41 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.067 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 36' ' ' ILE . 15.5 tpp180 -78.92 -40.83 31.08 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.199 -0.201 . . . . 0.0 110.698 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.5 t -57.3 -53.62 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.59 -30.71 51.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.963 0.411 . . . . 0.0 110.357 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -65.89 -40.98 92.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.962 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 32' ' ' ARG . 64.8 mt -65.85 -50.89 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.975 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.8 mt -58.56 -58.59 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 -178.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -61.01 -32.53 72.12 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.7 t -79.62 -38.68 33.29 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -176.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 9.1 mpt_? -75.6 -27.83 58.67 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.074 176.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.6 mm-40 -115.78 84.16 12.53 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.122 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.82 -12.83 36.08 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.363 2.042 . . . . 0.0 111.966 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.4 m -79.76 -8.62 59.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.375 177.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.6 mt -113.1 26.96 10.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.09 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -69.69 -23.39 63.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.403 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.69 21.43 1.53 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.024 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.0 m -75.1 91.08 2.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.83 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -53.0 125.86 41.63 Favored Pre-proline 0 CA--C 1.52 -0.211 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.998 173.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.27 -15.18 17.74 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.836 2.357 . . . . 0.0 112.159 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.514 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 16.7 m-20 -85.2 -29.79 24.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.555 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -139.6 59.68 1.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.697 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 18.9 mt -69.64 125.0 26.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.083 0.468 . . . . 0.0 111.508 -175.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -104.93 126.33 51.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.616 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 60.2 mt -107.28 108.3 24.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 173.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.455 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.5 p-10 -110.53 103.6 12.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.83 0.824 . . . . 0.0 110.762 176.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -69.68 -12.28 61.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.556 -174.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -74.56 -27.68 60.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.458 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.1 p -95.54 -28.03 15.07 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.097 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.6 mt -56.62 127.1 29.7 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 177.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -71.46 146.95 92.27 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -43.5 -32.85 3.92 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.864 2.376 . . . . 0.0 113.004 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.46 -54.72 43.87 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.686 0.279 . . . . 0.0 110.645 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -60.88 -47.73 85.03 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.234 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.3 mt -55.74 -39.87 71.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.92 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.3 tpt180 -70.47 -49.25 50.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.244 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -63.8 -36.56 84.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.775 0.321 . . . . 0.0 110.632 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.551 ' O ' HG13 ' A' ' 71' ' ' VAL . 84.8 mt -60.82 -56.46 20.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.998 174.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -54.48 -43.03 71.4 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.99 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -60.16 -39.29 85.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.375 0.607 . . . . 0.0 110.35 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -75.85 -47.07 27.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.775 -176.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.671 HG12 HD11 ' A' ' 25' ' ' LEU . 11.7 m -64.08 -42.71 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.07 0.462 . . . . 0.0 110.641 -175.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 25.3 p -67.69 -32.29 72.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.491 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.7 t -66.15 -25.32 66.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.263 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.7 t -91.72 -45.37 8.47 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.977 0.418 . . . . 0.0 110.414 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 25' ' ' LEU . 26.7 mt -85.51 -28.5 24.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -169.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 30.7 mtp180 -80.43 8.8 6.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.476 0.655 . . . . 0.0 110.116 177.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.9 tttp . . . . . 0 N--CA 1.449 -0.483 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.077 170.486 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 58.3 mt . . . . . 0 C--O 1.235 0.323 0 CA-C-O 121.14 0.495 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.499 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 47.3 t -92.91 108.03 19.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.62 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 4.4 ttmp? -104.28 109.8 21.77 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.135 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -126.84 151.1 48.8 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.044 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 67.6 mttm . . . . . 0 C--N 1.319 -0.743 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.6 m . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 120.922 0.391 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -68.27 144.17 96.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.26 149.72 88.23 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.843 2.362 . . . . 0.0 112.075 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -85.95 119.89 26.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 p -67.6 174.64 3.35 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -46.95 84.29 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.762 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -51.26 -48.7 62.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.682 0.753 . . . . 0.0 109.943 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -65.15 -46.06 82.47 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.062 -175.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.03 -38.98 73.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.268 176.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 16' ' ' ARG . 39.1 ttp180 -62.76 -44.37 96.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.327 175.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -59.74 -43.47 94.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.502 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.778 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -66.42 -38.06 86.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.305 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.7 p -65.37 -26.8 68.17 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.628 -0.67 . . . . 0.0 110.359 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.86 -43.87 19.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.396 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.778 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -64.09 -43.8 94.26 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.775 178.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.21 -41.96 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.931 0.396 . . . . 0.0 110.724 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -70.25 -27.44 64.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -74.5 -33.97 62.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.491 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.561 HD23 HD21 ' A' ' 75' ' ' LEU . 77.9 mt -56.94 138.19 79.13 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.333 -175.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.693 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 59.0 Cg_endo -79.22 163.24 25.22 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 123.521 2.814 . . . . 0.0 111.583 178.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.31 -27.15 60.13 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.151 -0.931 . . . . 0.0 114.855 -169.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.514 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.4 mp0 -63.07 -54.47 37.46 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.594 0.697 . . . . 0.0 109.711 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.693 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 3.8 mptt -72.22 -26.7 62.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.902 -176.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.4 mt -63.02 -25.7 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.014 176.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.26 -33.57 86.46 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.944 174.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.44 ' O ' HG13 ' A' ' 36' ' ' ILE . 9.0 tpp180 -79.96 -41.99 24.86 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 122.752 -0.264 . . . . 0.0 110.37 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -56.36 -52.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.472 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.83 -31.24 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.477 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -66.18 -42.14 89.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.998 176.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.1 mt -65.93 -51.4 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.6 mt -57.72 -59.31 3.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.779 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.424 ' OE1' ' HA ' ' A' ' 45' ' ' LYS . 9.9 mt-30 -61.93 -33.74 74.81 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -76.56 -36.28 57.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.592 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -78.47 -31.24 47.79 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.075 0.464 . . . . 0.0 110.024 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.492 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 16.5 mm-40 -116.33 83.26 12.8 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.105 -177.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.89 -15.13 48.84 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.389 2.059 . . . . 0.0 112.456 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -74.52 -19.75 60.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.987 0.422 . . . . 0.0 110.199 177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -95.5 19.01 11.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.424 ' HA ' ' OE1' ' A' ' 38' ' ' GLN . 55.1 tttm -69.98 -9.12 54.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.275 0.56 . . . . 0.0 110.598 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -87.14 11.0 15.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.916 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.5 m -72.81 91.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 46.9 m-80 -62.96 121.76 70.73 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 76.8 Cg_exo -46.99 -34.89 17.47 Favored 'Trans proline' 0 N--CA 1.477 0.526 0 C-N-CA 124.202 3.268 . . . . 0.0 114.977 -170.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.75 -22.44 61.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 111.526 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -140.55 70.65 1.36 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.05 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.4 mt -86.33 121.21 37.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.846 0.355 . . . . 0.0 110.772 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -104.51 126.55 51.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.615 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.411 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.8 mt -103.66 109.79 28.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 120.655 0.264 . . . . 0.0 110.551 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -107.15 99.13 8.7 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.157 0.98 . . . . 0.0 110.626 175.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -68.14 -4.32 13.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.739 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -80.01 -22.66 42.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.602 0.239 . . . . 0.0 110.823 -178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -101.17 -24.42 14.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.782 0.325 . . . . 0.0 110.153 176.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 37.4 mt -59.46 125.2 22.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.071 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.32 149.6 91.56 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.051 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -42.7 -36.43 4.94 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.722 2.281 . . . . 0.0 113.452 174.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 m -56.92 -55.02 39.92 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.411 0.148 . . . . 0.0 111.215 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.407 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.7 m -59.84 -46.11 90.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.208 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.96 -37.32 76.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -73.77 -44.81 54.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.5 -39.83 92.34 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.848 0.356 . . . . 0.0 110.435 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.539 ' O ' HG13 ' A' ' 71' ' ' VAL . 90.8 mt -60.67 -55.79 29.05 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.27 175.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -55.77 -45.9 78.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.341 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.06 -39.09 77.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -77.44 -47.16 20.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.038 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.554 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.6 m -62.72 -36.56 75.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.078 0.466 . . . . 0.0 110.735 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.0 p -72.22 -30.71 65.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.701 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -71.79 -19.97 61.93 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.862 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.492 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 47.6 t -90.95 -51.86 5.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.766 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.561 HD21 HD23 ' A' ' 25' ' ' LEU . 65.5 mt -79.21 -37.96 36.89 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 31.5 mtp180 -79.51 -5.53 55.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.75 -177.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.2 tttt . . . . . 0 C--N 1.324 -0.508 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.931 176.705 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 68.6 mt . . . . . 0 N--CA 1.455 -0.224 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.411 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 44.2 t -92.74 103.34 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.138 -175.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.7 ttmm -93.91 100.83 12.92 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -105.47 124.1 48.99 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.561 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 64.3 mttm . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.705 -177.122 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 120.944 0.402 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -73.49 141.67 80.23 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.45 123.66 14.29 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 123.115 2.543 . . . . 0.0 112.016 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.4 mmt -57.63 132.41 53.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.145 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 p -77.75 174.77 10.61 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.47 -45.96 84.21 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 109.919 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -56.41 -44.86 80.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.816 -179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.69 -47.09 79.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.432 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -57.79 -40.4 79.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.277 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.5 ttp-105 -59.97 -45.43 92.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.238 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -61.78 -41.43 97.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.383 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.725 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.11 -41.16 82.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.925 -178.234 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.444 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 98.5 p -63.15 -25.16 68.22 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.526 -0.734 . . . . 0.0 110.592 175.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.9 mt -82.24 -45.28 15.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.633 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.725 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -61.78 -42.25 98.75 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.82 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.425 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.4 mt -59.65 -40.69 82.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.067 0.461 . . . . 0.0 110.656 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -71.33 -20.11 62.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.307 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.7 mtpp -85.15 -14.86 45.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.13 0.491 . . . . 0.0 110.437 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.547 HD11 HG12 ' A' ' 71' ' ' VAL . 92.7 mt -80.03 139.69 53.34 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.189 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.556 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 98.6 Cg_endo -80.61 171.84 14.12 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 123.206 2.604 . . . . 0.0 112.983 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.68 -38.68 64.54 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.622 -0.323 . . . . 0.0 113.33 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 11.1 mp0 -50.53 -56.39 11.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.603 0.716 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.613 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.3 mptp? -78.24 -27.91 47.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.595 -175.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.08 -31.06 64.85 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.745 175.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.39 -40.91 96.68 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.655 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HG2' ' CE1' ' A' ' 70' ' ' TYR . 5.0 tpp180 -73.74 -40.99 63.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.428 0.156 . . . . 0.0 110.8 178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.507 HG13 HD22 ' A' ' 67' ' ' LEU . 60.7 t -56.58 -55.05 21.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.876 0.37 . . . . 0.0 110.65 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 52' ' ' ILE . 7.1 p -65.71 -27.85 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -65.27 -43.64 90.62 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.844 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.25 -42.77 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.145 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.1 mt -62.64 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.767 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -63.66 -32.43 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -173.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -72.58 -38.63 67.84 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.812 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.99 -30.8 56.1 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.93 0.395 . . . . 0.0 110.539 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 31.3 mm-40 -117.9 82.07 16.53 Favored Pre-proline 0 N--CA 1.445 -0.685 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.034 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.5 -8.72 23.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.587 2.191 . . . . 0.0 112.838 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -87.48 -5.08 58.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.136 0.493 . . . . 0.0 110.439 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -105.11 25.56 10.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.148 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -76.72 -10.72 59.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.439 0.638 . . . . 0.0 109.684 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -78.99 0.5 27.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.767 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.2 m -69.78 99.37 1.35 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.253 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 p30 -57.06 124.35 65.09 Favored Pre-proline 0 CA--C 1.517 -0.295 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 173.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.6 Cg_exo -57.63 -11.69 9.64 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.935 2.424 . . . . 0.0 112.172 177.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -84.05 -36.07 23.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.634 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -136.44 65.31 1.52 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.775 0.322 . . . . 0.0 111.536 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 34' ' ' VAL . 18.1 mt -76.49 124.52 34.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.117 0.484 . . . . 0.0 111.438 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -108.82 110.73 22.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.837 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.406 HD12 ' HB ' ' B' ' 205' ' ' VAL . 53.8 mt -82.27 110.42 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.77 0.319 . . . . 0.0 110.383 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.663 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.0 t70 -103.95 99.0 8.76 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -71.97 -8.12 52.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.169 -176.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -84.22 -34.0 23.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.868 0.366 . . . . 0.0 110.792 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 56.6 p -78.15 -31.89 49.99 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.839 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 32.5 mt -58.91 128.48 37.44 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.904 -176.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 13.8 mtmm -72.36 150.97 91.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.871 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.15 -36.75 29.57 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.363 2.042 . . . . 0.0 112.518 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -59.26 -47.27 85.97 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.488 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -63.76 -47.67 80.07 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.173 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 71.6 mt -59.35 -35.26 73.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.086 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.9 tpt180 -72.1 -46.22 57.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.083 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -66.48 -39.71 88.91 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.962 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 89.7 mt -56.96 -57.06 14.18 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.699 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.06 -42.48 76.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.244 177.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 54.1 ttp85 -64.49 -33.45 75.92 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.162 0.506 . . . . 0.0 110.57 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.431 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 71.5 t80 -80.72 -47.17 14.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.782 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.608 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.0 m -62.54 -37.97 80.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.104 0.478 . . . . 0.0 110.637 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.8 p -70.28 -36.7 74.55 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.849 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -62.66 -28.01 69.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.393 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.613 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 44.4 t -89.55 -54.24 4.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.595 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.9 mt -76.1 -35.88 59.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -171.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 54.4 mtp180 -75.73 -5.43 45.66 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.043 -177.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 49.9 tttp . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.741 175.914 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 60.4 mt . . . . . 0 N--CA 1.456 -0.167 0 CA-C-O 121.113 0.482 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.444 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 66.6 t -77.73 134.45 28.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.467 -174.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -111.23 131.76 54.87 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.58 144.63 30.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.129 0.49 . . . . 0.0 110.538 173.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 56.8 mttm . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.398 179.029 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.545 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 74.8 m . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 120.833 0.349 . . . . 0.0 110.961 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -71.32 144.95 90.08 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.986 0.422 . . . . 0.0 110.637 176.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -61.41 124.83 15.47 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.809 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.512 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -56.64 134.82 54.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.176 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 m -95.68 176.51 6.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -51.55 -54.5 26.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -166.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -48.93 -49.8 38.44 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.264 0.554 . . . . 0.0 110.691 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.94 -46.1 90.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.455 -174.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.512 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.8 mttt -58.01 -42.14 84.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.444 177.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -62.26 -44.76 95.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.334 177.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -63.93 -38.07 89.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.373 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.654 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.62 -39.19 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.756 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.6 p -64.26 -26.24 68.41 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.515 -0.74 . . . . 0.0 110.357 175.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 70.8 mt -81.68 -44.72 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.583 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.654 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.2 p30 -62.85 -41.7 99.47 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.676 178.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 25' ' ' LEU . 94.2 mt -60.26 -41.0 85.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.003 0.43 . . . . 0.0 110.679 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -71.16 -24.18 62.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.245 -177.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 29.1 mtpp -80.31 -22.0 41.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.597 HD11 HG12 ' A' ' 71' ' ' VAL . 92.1 mt -70.27 139.0 86.94 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.489 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.592 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 74.4 Cg_endo -75.15 161.89 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.975 2.45 . . . . 0.0 111.463 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.93 -22.86 58.37 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.337 -0.847 . . . . 0.0 114.003 -170.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -64.42 -52.08 59.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.338 0.589 . . . . 0.0 110.218 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 2.6 mptp? -69.31 -23.76 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.842 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.61 -27.52 69.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.65 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.86 -33.76 84.58 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.881 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.9 tpp180 -81.07 -40.84 23.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.447 0.165 . . . . 0.0 110.812 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.551 HG13 HD22 ' A' ' 67' ' ' LEU . 60.4 t -58.03 -52.05 63.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.918 0.39 . . . . 0.0 110.774 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.96 -30.16 49.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -177.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.53 -41.99 92.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.756 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 32' ' ' ARG . 71.2 mt -64.79 -41.75 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.103 178.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 33' ' ' VAL . 60.9 mt -64.19 -61.5 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.353 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.538 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 28.5 mt-30 -63.17 -30.32 71.49 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -76.48 -36.79 57.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -80.3 -28.2 38.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.662 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 58.5 mm-40 -111.43 81.35 3.04 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.075 176.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.07 -15.07 47.2 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.395 2.063 . . . . 0.0 112.718 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -84.9 -3.79 58.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.146 0.498 . . . . 0.0 110.494 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.59 23.72 14.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.79 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -64.4 -26.23 68.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.206 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -95.61 41.51 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.342 -178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.538 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 68.7 m -80.24 107.16 12.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.455 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 2.9 p30 -55.84 122.78 48.73 Favored Pre-proline 0 C--O 1.228 -0.066 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.63 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -61.18 -9.03 11.39 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.127 2.551 . . . . 0.0 112.648 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.486 ' CG ' ' HG2' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -82.98 -44.36 15.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.928 179.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HG2' ' CG ' ' A' ' 50' ' ' ASP . 5.5 mm-40 -133.57 70.53 1.46 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.481 -177.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.4 mt -74.35 116.14 16.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 CA-C-O 121.319 0.58 . . . . 0.0 110.253 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.0 mm-40 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.59 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 47.7 mt -89.63 107.8 18.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 175.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -107.95 98.74 8.27 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.224 1.011 . . . . 0.0 110.76 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -66.78 -7.95 24.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.849 -176.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.94 -20.31 49.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -177.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.6 p -104.5 -29.58 10.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.445 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.463 HD23 ' HG3' ' A' ' 41' ' ' GLU . 36.2 mt -51.28 123.93 10.65 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.365 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 57.4 mttp -67.01 152.56 95.88 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.271 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.65 -40.81 30.93 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.444 2.096 . . . . 0.0 112.998 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 21.9 t -54.64 -50.96 66.87 Favored 'General case' 0 C--N 1.334 -0.107 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -51.05 71.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.43 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' A' ' 59' ' ' LEU . 77.0 mt -56.47 -39.74 73.71 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.168 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 22.7 tpt180 -72.51 -46.75 53.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.344 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.2 mt-10 -68.22 -39.37 82.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.754 0.311 . . . . 0.0 110.718 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.553 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.9 mt -56.88 -55.25 36.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.593 173.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -56.04 -40.27 73.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.138 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -62.24 -43.71 98.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.441 0.639 . . . . 0.0 110.041 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -74.52 -43.89 53.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.716 -174.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.597 HG12 HD11 ' A' ' 25' ' ' LEU . 15.0 m -65.16 -37.63 80.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.993 0.425 . . . . 0.0 110.71 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.405 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 36.7 p -74.43 -35.71 63.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.327 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.7 p -67.27 -19.93 65.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.428 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 18.1 t -91.28 -54.84 3.75 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.626 178.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.541 HD21 HD23 ' A' ' 25' ' ' LEU . 72.3 mt -78.26 -33.86 49.38 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -171.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.405 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 67.5 mtp180 -81.32 0.09 38.68 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.713 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.704 173.816 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 40.6 mt . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.002 0.429 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 40.8 t -96.89 109.69 23.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.483 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 20.9 ttmm -95.8 111.05 23.11 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -127.67 144.35 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.613 176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.412 -178.386 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.8 m . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.851 0.358 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -72.08 147.01 90.64 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -62.77 123.7 12.78 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.874 2.383 . . . . 0.0 112.012 -176.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.531 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -55.37 136.02 49.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.625 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.7 m -91.75 175.21 6.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -51.76 -57.84 8.12 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -164.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -56.44 -34.12 66.53 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -177.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.36 -45.96 71.41 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.531 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.3 mttt -60.07 -42.12 93.87 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.846 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 16' ' ' ARG . 18.4 ttp85 -62.68 -43.5 98.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.483 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -67.23 -42.08 84.63 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.821 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.34 -50.03 74.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.264 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.422 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.1 p -59.77 -33.77 72.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.211 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.2 mt -71.59 -42.22 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.757 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.546 ' HB3' HD12 ' A' ' 75' ' ' LEU . 67.7 m-20 -62.61 -44.31 96.61 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.548 0.214 . . . . 0.0 111.165 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.417 ' HA ' HD12 ' A' ' 25' ' ' LEU . 96.8 mt -61.22 -34.31 60.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 0.0 111.35 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.98 -24.51 32.89 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.043 0.925 . . . . 0.0 108.747 -174.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.858 ' HD2' HD13 ' A' ' 75' ' ' LEU . 19.8 ttmt -73.06 -32.33 64.97 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.786 173.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.716 HD23 HD21 ' A' ' 75' ' ' LEU . 90.0 mt -62.6 142.12 96.77 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 121.153 0.502 . . . . 0.0 111.843 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.5 Cg_endo -82.38 169.56 13.94 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 123.045 2.497 . . . . 0.0 112.874 176.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.6 -46.0 53.83 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 114.482 0.553 . . . . 0.0 114.482 -172.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.424 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 3.2 mp0 -47.27 -56.83 6.02 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.823 0.82 . . . . 0.0 110.989 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.619 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -74.4 -24.88 59.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.814 -174.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 13.9 mt -65.13 -27.41 68.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.266 177.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.24 -34.38 89.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.967 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.467 ' O ' HG13 ' A' ' 36' ' ' ILE . 19.4 tpp180 -77.7 -39.65 44.0 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 67' ' ' LEU . 87.0 t -57.64 -55.24 22.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.024 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 p -63.51 -30.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.898 0.38 . . . . 0.0 110.615 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -63.86 -42.12 97.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.749 176.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.3 mt -66.0 -44.83 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -61.67 -60.55 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.165 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.36 -35.92 74.78 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -79.24 -33.85 43.26 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.98 -26.81 36.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.503 176.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' HD23 ' A' ' 59' ' ' LEU . 61.3 mm-40 -115.72 85.33 13.96 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.762 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -63.51 -13.2 34.91 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.23 1.954 . . . . 0.0 112.424 178.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.7 m -79.85 -10.04 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.001 0.429 . . . . 0.0 110.565 176.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -108.81 29.01 7.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.119 0.485 . . . . 0.0 110.21 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -69.12 -23.75 64.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.335 -175.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -95.55 25.02 4.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.503 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 p -73.25 101.03 3.27 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.398 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 2.7 p30 -56.06 122.48 48.07 Favored Pre-proline 0 C--O 1.227 -0.131 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.452 178.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.3 Cg_exo -58.25 -14.37 19.56 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.936 2.424 . . . . 0.0 112.039 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.07 -37.44 29.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.699 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -136.92 59.97 1.67 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.645 0.259 . . . . 0.0 111.442 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.611 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 19.7 mt -70.16 124.02 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.026 0.441 . . . . 0.0 111.496 -175.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' CD ' ' HB2' ' B' ' 206' ' ' LYS . 44.8 mm-40 -109.84 115.25 29.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.629 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 34.5 mt -90.11 109.97 21.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 177.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 16.0 p-10 -105.98 99.01 8.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.83 0.824 . . . . 0.0 110.659 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -69.94 -0.26 7.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.699 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -87.88 -22.58 24.33 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.219 -175.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 75.4 p -102.18 -32.9 9.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.834 176.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.535 HD23 ' HG3' ' A' ' 41' ' ' GLU . 35.5 mt -48.3 123.03 5.9 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.025 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -65.26 152.04 92.68 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.792 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -48.76 -35.04 29.43 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.435 2.09 . . . . 0.0 112.321 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 t -56.37 -53.04 62.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 176.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -46.54 88.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.718 -178.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.406 HD21 ' HB2' ' A' ' 59' ' ' LEU . 81.9 mt -59.14 -36.18 74.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -76.83 -45.31 29.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.076 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -62.29 -45.51 92.92 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.527 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.4 mt -57.37 -55.41 35.18 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.109 176.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -55.45 -47.99 75.19 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.17 -40.57 81.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.883 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -74.29 -47.57 33.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.641 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.8 m -65.26 -35.34 75.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.81 0.338 . . . . 0.0 110.312 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.498 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 35.6 p -72.88 -39.69 66.21 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.647 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 91.8 p -63.9 -21.77 66.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.729 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.619 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.2 t -90.77 -48.22 7.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.798 0.332 . . . . 0.0 110.316 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.858 HD13 ' HD2' ' A' ' 24' ' ' LYS . 70.6 mt -82.37 -37.09 26.14 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -171.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.498 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 82.6 mtp180 -77.08 -7.41 55.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.076 0.465 . . . . 0.0 110.377 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.507 173.93 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.185 0.517 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.422 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.3 t -114.92 104.09 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.359 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.611 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.1 ttmm -90.12 109.59 20.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 171.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -124.65 137.84 54.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp . . . . . 0 C--N 1.319 -0.747 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.353 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.941 0.401 . . . . 0.0 111.528 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -65.8 147.18 98.88 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.341 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -72.07 140.55 34.71 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.594 2.196 . . . . 0.0 111.252 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.497 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.63 120.2 23.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.297 -177.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.9 p -69.92 179.45 2.26 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.51 -50.81 72.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 121.273 -0.171 . . . . 0.0 110.981 -173.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -56.8 -41.76 78.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.834 0.35 . . . . 0.0 111.073 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.29 -44.96 93.53 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.731 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.9 mttt -62.7 -41.04 98.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.688 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttp85 -64.36 -43.15 95.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 110.107 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.24 -41.73 97.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.739 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.774 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.99 -32.6 72.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.103 -176.04 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.6 p -68.38 -26.76 65.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.624 -0.673 . . . . 0.0 109.925 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.7 mt -83.8 -39.18 20.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.691 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.774 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.5 p30 -66.17 -41.1 90.78 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.896 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.8 mt -60.94 -40.31 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 0.0 110.096 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -66.67 -29.07 68.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 48.6 mttp -66.25 -28.65 68.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.107 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.657 HD11 HG12 ' A' ' 71' ' ' VAL . 94.5 mt -76.39 135.84 68.83 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.385 -171.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.481 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 86.7 Cg_endo -81.72 171.94 12.73 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.265 2.643 . . . . 0.0 112.531 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.83 -45.11 61.32 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 114.333 0.493 . . . . 0.0 114.333 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -46.66 -52.69 13.22 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.532 0.682 . . . . 0.0 111.478 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -80.47 -29.24 37.44 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.057 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' B' ' 207' ' ' PHE . 12.9 tp -63.19 -24.28 67.81 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.825 0.345 . . . . 0.0 110.2 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.76 -37.02 94.14 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 111.807 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.481 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.7 tpp180 -75.47 -39.02 59.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.442 HG13 HD22 ' A' ' 67' ' ' LEU . 60.0 t -57.33 -55.01 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.076 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.49 -30.81 51.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.022 0.439 . . . . 0.0 110.482 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -64.29 -41.54 96.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.153 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 32' ' ' ARG . 67.7 mt -63.76 -47.35 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.396 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 33' ' ' VAL . 46.5 mt -63.95 -59.56 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.341 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.58 -31.29 70.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 t -77.99 -39.53 42.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.891 -0.324 . . . . 0.0 111.401 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.06 -28.58 57.68 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.073 0.463 . . . . 0.0 110.447 176.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -116.9 78.98 9.76 Favored Pre-proline 0 N--CA 1.44 -0.929 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.468 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.27 -15.66 49.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.18 1.92 . . . . 0.0 112.391 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.3 t -73.08 -12.72 61.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.133 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.09 23.31 14.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -65.29 -31.6 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.725 0.297 . . . . 0.0 111.262 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -85.65 41.95 0.93 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.255 0.55 . . . . 0.0 110.735 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.0 m -84.5 99.99 11.07 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -52.81 117.01 10.05 Favored Pre-proline 0 CA--C 1.523 -0.093 0 O-C-N 123.75 0.656 . . . . 0.0 110.233 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.97 -31.74 45.0 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.701 2.934 . . . . 0.0 114.222 -172.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -73.87 -27.74 61.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.2 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -141.49 79.18 1.67 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.152 0.501 . . . . 0.0 109.652 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.418 HD12 ' CE1' ' B' ' 207' ' ' PHE . 50.5 mt -89.84 126.55 42.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.501 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 33.9 mm-40 -98.78 123.34 42.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.917 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.4 mt -98.01 108.59 22.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 170.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -108.92 100.8 9.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.141 0.972 . . . . 0.0 110.587 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -70.58 -2.85 15.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.546 -1.206 . . . . 0.0 112.128 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -83.0 -23.29 33.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.0 p -97.98 -26.67 14.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.958 0.409 . . . . 0.0 110.095 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.2 mt -58.75 127.53 32.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.047 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -69.76 147.8 96.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -44.19 -34.82 7.29 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.54 2.16 . . . . 0.0 113.095 173.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.6 m -56.69 -51.71 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.145 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -63.37 -45.65 90.14 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.261 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.7 mt -59.07 -35.09 72.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.717 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -71.54 -51.54 22.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.121 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -57.49 -42.86 83.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.543 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.582 ' O ' HG13 ' A' ' 71' ' ' VAL . 78.8 mt -58.69 -58.96 6.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.6 177.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -57.21 -45.42 83.84 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.765 0.317 . . . . 0.0 111.297 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -58.54 -38.63 78.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.27 0.557 . . . . 0.0 110.612 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -75.59 -47.89 24.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.653 -177.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.676 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.5 m -62.9 -39.85 86.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.069 0.461 . . . . 0.0 110.396 -176.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.6 p -68.67 -30.81 69.58 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.105 -178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 85.6 p -68.96 -23.19 64.11 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.377 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.497 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 45.6 t -92.43 -44.95 8.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.121 0.486 . . . . 0.0 110.542 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.562 HD21 HD23 ' A' ' 25' ' ' LEU . 27.9 mt -83.41 -33.76 25.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.574 -171.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.3 mtp180 -78.31 -1.56 33.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.249 0.547 . . . . 0.0 110.05 176.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 tttp . . . . . 0 N--CA 1.451 -0.411 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.253 172.885 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . 0.419 HD12 ' N ' ' B' ' 204' ' ' ILE . 4.3 mp . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.846 0.355 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 60.4 t -104.05 109.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.136 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.501 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.1 ttmm -99.75 81.9 2.53 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.55 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.5 p90 -93.35 159.19 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.003 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.6 ' SG ' ' HB2' ' A' ' 65' ' ' ARG . 52.8 t . . . . . 0 CA--C 1.516 -0.327 0 CA-C-O 120.746 0.307 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -85.23 145.31 42.54 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.027 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -64.23 127.45 19.24 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.85 2.367 . . . . 0.0 111.69 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -61.27 128.86 38.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.226 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.6 p -75.0 176.73 6.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -48.23 80.76 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -53.31 -46.84 69.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.364 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.27 -45.23 77.26 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.864 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.9 mttt -56.46 -38.56 71.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.18 175.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -60.93 -45.31 95.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.314 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -62.95 -39.94 96.15 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.591 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.615 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -69.07 -30.64 69.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.202 -178.269 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.532 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 80.9 p -69.71 -30.03 67.56 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.431 -0.793 . . . . 0.0 110.011 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.6 mt -80.25 -39.18 29.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.608 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.615 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.3 p30 -68.0 -42.48 80.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.397 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -59.5 -39.36 79.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.558 177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -67.16 -30.86 70.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.902 0.382 . . . . 0.0 111.138 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 75' ' ' LEU . 77.4 mttt -62.54 -30.04 71.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.842 175.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.682 HD11 HG12 ' A' ' 71' ' ' VAL . 95.9 mt -73.36 139.28 78.44 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.381 -172.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.03 170.28 15.34 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.127 2.552 . . . . 0.0 112.866 177.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.79 -46.26 48.49 Favored Glycine 0 C--N 1.333 0.39 0 O-C-N 123.368 0.418 . . . . 0.0 113.649 -174.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.6 mp0 -47.03 -56.87 5.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.265 0.555 . . . . 0.0 110.988 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -27.09 61.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.52 -176.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.2 -25.16 67.64 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.773 0.32 . . . . 0.0 110.547 178.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.38 92.74 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.073 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 32' ' ' ARG . 5.4 tpp180 -76.8 -40.19 48.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.666 0.27 . . . . 0.0 110.537 177.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.451 HG13 HD22 ' A' ' 67' ' ' LEU . 58.0 t -57.75 -54.07 36.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.897 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.31 -29.84 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.573 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.87 -45.29 90.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.644 176.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.7 -47.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.845 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.6 mt -62.63 -58.99 5.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.768 -178.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -62.74 -30.98 71.84 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.3 t -70.39 -50.73 35.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.602 0.239 . . . . 0.0 110.895 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -69.29 -30.85 69.02 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.94 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.42 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 15.9 mm-40 -116.97 81.29 12.14 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.649 -178.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.03 -18.38 64.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.4 2.066 . . . . 0.0 113.104 -177.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.7 t -70.42 -27.79 64.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.036 0.446 . . . . 0.0 110.114 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.38 23.27 1.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.833 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -72.03 -13.0 61.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.365 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -85.14 4.8 32.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.286 0.565 . . . . 0.0 110.621 -177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.4 m -66.86 104.7 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.159 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 123.66 71.89 Favored Pre-proline 0 CA--C 1.52 -0.2 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 173.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.75 -14.28 17.12 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.001 2.468 . . . . 0.0 112.409 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.04 -33.64 22.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.928 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -137.29 68.02 1.42 Allowed 'General case' 0 C--O 1.227 -0.112 0 CA-C-O 120.713 0.292 . . . . 0.0 110.758 -178.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.442 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.9 mt -78.42 122.09 32.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.346 -175.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -102.34 122.13 43.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.558 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.0 mt -93.63 109.0 21.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -105.42 95.51 5.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.14 0.972 . . . . 0.0 110.627 176.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -66.47 -5.27 10.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.28 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -82.23 -27.97 32.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.634 0.254 . . . . 0.0 110.944 -177.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.3 p -93.05 -22.48 19.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.418 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 27.1 mt -59.9 131.8 51.99 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.078 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.42 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 11.8 mtmm -82.79 153.84 67.66 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.119 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.2 -43.94 24.83 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.446 2.097 . . . . 0.0 113.057 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 70.6 m -52.23 -52.0 54.96 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.147 0.279 . . . . 0.0 111.153 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -60.75 -45.68 93.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 64.0 mt -60.9 -36.83 80.27 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.01 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.6 ' HB2' ' SG ' ' A' ' 7' ' ' CYS . 32.1 tpt180 -70.75 -50.33 37.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 177.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 62' ' ' SER . 60.0 mm-40 -59.05 -41.05 86.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.905 0.383 . . . . 0.0 110.225 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 71' ' ' VAL . 80.1 mt -61.91 -58.16 9.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.692 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.48 -45.23 73.16 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.056 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.86 -36.23 80.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.924 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 69.6 t80 -75.78 -49.11 19.06 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.549 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.682 HG12 HD11 ' A' ' 25' ' ' LEU . 13.7 m -62.65 -40.36 88.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.122 0.486 . . . . 0.0 110.537 -175.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.415 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 29.1 p -65.63 -35.14 79.92 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.082 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.9 p -66.0 -24.77 66.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 110.624 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 44.0 t -91.33 -41.99 10.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.743 0.306 . . . . 0.0 110.579 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.546 HD21 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.7 -38.36 13.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -168.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 39.6 mtp180 -73.28 -4.71 34.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.853 0.835 . . . . 0.0 109.227 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.0 tttt . . . . . 0 N--CA 1.448 -0.555 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.132 170.952 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 CA--C 1.522 -0.129 0 CA-C-O 121.794 0.807 . . . . 0.0 111.401 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.532 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 57.7 t -87.8 113.47 25.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.103 -176.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 19.7 ttmm -96.51 113.77 25.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.73 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -125.38 139.73 53.41 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.351 0.596 . . . . 0.0 110.6 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 62.7 mttm . . . . . 0 C--N 1.32 -0.699 0 CA-C-N 115.316 -0.856 . . . . 0.0 108.696 175.017 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.478 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 55.7 m . . . . . 0 N--CA 1.444 -0.729 0 CA-C-O 121.225 0.536 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -87.4 143.91 34.98 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.785 177.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.08 123.31 12.64 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.795 2.33 . . . . 0.0 111.433 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.4 mmt -62.81 130.12 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.634 -176.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.0 m -90.14 177.68 6.37 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -57.64 -54.11 50.58 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -165.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -48.99 -41.26 33.76 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.41 -48.39 70.2 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.694 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 10' ' ' MET . 95.0 mttt -57.58 -40.73 79.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.279 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -63.78 -47.07 82.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.335 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -60.33 -46.11 91.05 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.19 -48.21 82.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.471 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.589 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.7 p -60.81 -32.99 72.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.144 0.497 . . . . 0.0 110.753 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -76.68 -34.93 58.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.547 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.468 ' HB3' HD12 ' A' ' 75' ' ' LEU . 64.0 m-20 -68.91 -41.93 77.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.228 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.16 -35.22 60.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.948 0.404 . . . . 0.0 110.664 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.95 -24.88 59.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.764 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.6 mttp -66.33 -42.84 87.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.295 0.569 . . . . 0.0 110.363 172.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD11 HG12 ' A' ' 71' ' ' VAL . 96.1 mt -58.41 136.04 85.45 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.651 -174.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.1 Cg_endo -80.3 172.43 13.7 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.381 2.72 . . . . 0.0 112.88 177.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.46 -46.3 52.86 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 123.328 0.393 . . . . 0.0 114.034 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -48.71 -58.21 5.11 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.208 0.528 . . . . 0.0 111.843 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.575 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.3 mptp? -71.22 -23.91 62.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.964 -175.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -63.63 -26.72 68.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.336 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.63 89.87 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.026 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.405 ' O ' HG13 ' A' ' 36' ' ' ILE . 22.6 tpp180 -78.76 -41.0 31.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.538 0.209 . . . . 0.0 110.578 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 HD22 ' A' ' 67' ' ' LEU . 95.6 t -55.97 -55.53 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.004 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.97 -31.8 53.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.604 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -64.95 -41.09 95.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.884 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.7 mt -64.95 -44.93 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.177 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -62.25 -61.64 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.972 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -61.78 -31.83 72.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -173.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -79.81 -30.93 40.65 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.698 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -83.96 -25.32 30.16 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.227 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.06 81.68 16.6 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.508 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.89 -16.18 53.33 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.694 2.263 . . . . 0.0 113.116 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 m -78.48 -8.4 58.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.013 0.435 . . . . 0.0 110.317 176.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.6 mt -110.07 28.81 8.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.228 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -81.81 -8.33 59.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.469 0.652 . . . . 0.0 110.514 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -103.4 30.46 4.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.708 176.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.0 m -72.48 110.88 7.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.578 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.79 118.6 13.73 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 123.204 0.315 . . . . 0.0 110.202 175.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.99 -13.03 32.61 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.705 2.27 . . . . 0.0 111.109 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 4.3 m-20 -78.29 -37.46 44.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.16 -178.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.11 60.94 1.36 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.502 0.191 . . . . 0.0 110.993 -176.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 16.2 mt -63.21 123.48 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.039 0.447 . . . . 0.0 111.898 -173.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' B' ' 206' ' ' LYS . 41.0 mm-40 -100.7 116.96 33.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.432 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.6 mt -95.35 107.25 19.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 174.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -107.48 98.38 8.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.907 0.861 . . . . 0.0 110.273 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -68.59 -6.07 23.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.867 -1.061 . . . . 0.0 112.162 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -76.8 -31.11 56.75 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.77 0.319 . . . . 0.0 110.84 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 p -93.32 -22.82 18.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.43 131.56 50.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.11 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -74.29 152.8 88.11 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.079 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -49.27 -34.88 32.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.599 2.199 . . . . 0.0 111.939 174.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.5 m -56.79 -52.4 65.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.252 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.18 -47.86 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.616 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.02 -35.3 69.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.15 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.478 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 27.9 tpt180 -73.35 -49.97 24.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.779 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -63.63 -41.51 98.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.782 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.58 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.3 mt -58.33 -55.87 29.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.334 176.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -55.81 -47.75 76.62 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.882 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -57.65 -38.15 74.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.097 0.475 . . . . 0.0 110.873 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -75.61 -49.28 18.96 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.589 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.58 HG13 ' O ' ' A' ' 67' ' ' LEU . 6.3 m -63.91 -39.85 86.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.763 0.316 . . . . 0.0 110.27 -175.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.6 p -67.04 -35.64 80.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.11 -178.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -67.91 -24.51 65.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.866 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.487 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.1 t -91.96 -26.26 18.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.05 0.452 . . . . 0.0 110.814 -178.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 HD23 ' A' ' 25' ' ' LEU . 31.1 mt -103.45 -44.99 4.98 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -171.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -69.88 -16.09 63.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.0 tttt . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.043 176.805 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 32.4 mm . . . . . 0 N--CA 1.454 -0.239 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.589 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.4 t -109.64 129.74 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.253 -173.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 53' ' ' GLU . 37.6 ttmt -118.25 117.66 29.72 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.403 ' CE2' HD11 ' A' ' 54' ' ' ILE . 23.2 p90 -133.42 145.08 49.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.252 0.549 . . . . 0.0 111.274 -178.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 55.9 mttp . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.294 173.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 85.3 m . . . . . 0 C--O 1.234 0.271 0 CA-C-O 120.798 0.332 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.03 148.34 47.66 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.093 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.18 129.8 28.35 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.0 2.467 . . . . 0.0 112.399 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.45 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -66.31 132.7 48.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.48 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 p -75.44 177.04 6.96 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.3 -47.81 84.45 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.285 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.68 -47.05 70.8 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.345 0.593 . . . . 0.0 109.874 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.26 -46.86 84.88 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.652 -176.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.2 mttt -58.19 -40.01 80.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.154 176.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -63.25 -42.94 99.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.547 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -64.37 -36.06 82.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.943 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.735 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.42 -31.8 69.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.735 178.818 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.529 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 60.4 p -70.0 -25.32 63.55 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.569 -0.707 . . . . 0.0 110.001 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.3 -39.27 17.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.334 -178.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.735 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -67.61 -41.27 84.27 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.804 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -60.17 -38.6 77.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.171 0.51 . . . . 0.0 110.15 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -68.35 -31.15 70.34 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.753 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 47.6 mttp -63.39 -38.87 92.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.024 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.631 HD11 HG12 ' A' ' 71' ' ' VAL . 94.3 mt -64.38 135.17 96.24 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.681 -173.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -80.36 172.78 13.21 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.533 2.822 . . . . 0.0 113.012 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.8 -46.93 48.18 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.275 0.47 . . . . 0.0 114.275 -172.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.56 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.1 mp0 -48.74 -52.6 22.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.683 0.754 . . . . 0.0 111.335 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.547 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.5 mptp? -76.4 -24.36 54.07 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.193 -173.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.87 -29.19 68.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.046 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.04 -43.72 99.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.783 176.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.592 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.6 tpm_? -68.47 -42.11 79.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.686 0.279 . . . . 0.0 110.66 177.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.597 HG13 HD22 ' A' ' 67' ' ' LEU . 88.3 t -58.17 -58.03 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.927 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 p -62.45 -29.53 47.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.514 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -69.63 -41.82 75.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.323 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.592 HG13 ' HE ' ' A' ' 32' ' ' ARG . 64.4 mt -61.69 -41.83 91.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 175.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.479 HG23 HD21 ' A' ' 59' ' ' LEU . 72.7 mt -62.7 -60.45 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.002 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -174.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -72.53 -42.89 64.24 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.988 -178.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.27 -35.81 71.5 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.557 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.517 ' HG3' HD23 ' A' ' 59' ' ' LEU . 55.6 mm-40 -114.73 86.14 12.53 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.776 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -64.25 -16.26 54.07 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.233 1.956 . . . . 0.0 112.365 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 m -77.36 -12.27 59.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.923 0.392 . . . . 0.0 110.711 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 61.4 mt -99.99 26.44 6.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.123 0.487 . . . . 0.0 110.498 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -70.52 -15.11 62.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.437 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -81.06 11.82 3.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 m -72.57 94.37 1.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.401 176.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.3 119.36 55.56 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -49.84 -31.33 26.08 Favored 'Trans proline' 0 N--CA 1.476 0.452 0 C-N-CA 123.872 3.048 . . . . 0.0 114.651 -174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -74.61 -28.99 61.13 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.134 -0.227 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -140.3 72.95 1.41 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -175.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 26.8 mt -87.3 126.1 41.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.798 0.332 . . . . 0.0 111.377 -176.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.421 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.8 mm-40 -103.43 116.22 32.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.897 178.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.458 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.0 mt -88.99 108.36 18.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -107.88 100.2 9.59 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 122.135 0.969 . . . . 0.0 110.466 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -67.22 -10.12 47.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.235 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -77.15 -30.21 54.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.098 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.4 p -89.31 -26.58 21.04 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 109.922 177.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 41' ' ' GLU . 39.7 mt -59.0 126.97 29.91 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.822 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.413 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 20.4 mtmm -68.6 151.11 97.43 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.94 -34.76 17.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.522 2.148 . . . . 0.0 112.436 174.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -55.92 -56.21 23.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.495 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -58.87 -46.29 88.14 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.677 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.5 mt -58.57 -35.76 72.89 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.974 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.465 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 31.0 tpt180 -76.39 -47.39 23.42 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.001 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -60.33 -42.65 96.11 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.771 0.32 . . . . 0.0 110.42 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.597 HD22 HG13 ' A' ' 33' ' ' VAL . 80.2 mt -59.49 -58.27 9.36 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.482 175.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -54.38 -47.15 73.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -58.03 -37.45 74.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.206 0.527 . . . . 0.0 110.56 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' SER . 62.8 t80 -74.77 -47.53 30.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.764 -179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.645 HG21 ' CG ' ' A' ' 21' ' ' ASP . 10.7 m -63.42 -40.96 90.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.002 0.43 . . . . 0.0 110.347 -176.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.48 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.3 p -67.59 -31.0 70.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.331 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 70' ' ' TYR . 45.2 t -59.96 -33.66 72.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.397 175.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.498 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.5 t -91.56 -36.13 13.87 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.736 0.303 . . . . 0.0 111.025 -175.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.519 HD21 HD23 ' A' ' 25' ' ' LEU . 21.0 mt -94.17 -29.43 15.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -170.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 72' ' ' THR . 72.2 mtp180 -76.23 -16.42 59.82 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.8 tttp . . . . . 0 N--CA 1.45 -0.427 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.133 171.897 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 50.4 mt . . . . . 0 N--CA 1.454 -0.255 0 CA-C-O 121.016 0.436 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 48.7 t -87.69 104.87 14.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.313 -175.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 3.9 ttmp? -91.73 103.98 16.49 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.473 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -116.65 151.57 36.02 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.383 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp . . . . . 0 C--N 1.319 -0.747 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.174 -178.24 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -83.95 134.08 44.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 121.728 0.775 . . . . 0.0 112.429 -173.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -53.91 129.55 34.76 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 124.069 3.179 . . . . 0.0 112.197 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.5 mmt -66.24 149.19 50.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.725 -175.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 19.1 p -86.06 172.74 10.38 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 171.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.28 -46.29 90.35 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 118.704 0.684 . . . . 0.0 109.314 -178.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -53.67 -48.13 69.76 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.177 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.43 -44.89 92.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.95 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 11' ' ' SER . 45.3 mttp -59.58 -38.81 82.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.651 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.3 ttp-105 -60.07 -42.14 93.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.074 0.464 . . . . 0.0 109.947 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -63.79 -39.21 93.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.468 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.812 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.62 -39.59 73.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.549 -178.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.455 ' HB2' HG21 ' B' ' 205' ' ' VAL . 85.7 p -61.45 -29.74 70.14 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.531 -0.731 . . . . 0.0 110.233 174.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 58.6 mt -78.58 -43.22 27.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.637 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.812 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.8 p30 -63.12 -41.32 99.3 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.682 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.9 mt -59.31 -41.05 82.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.68 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.421 HD22 ' HA ' ' A' ' 23' ' ' ASN . 8.1 m120 -72.09 -21.0 61.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.649 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.5 mtpp -84.94 -13.4 50.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.06 0.457 . . . . 0.0 110.248 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.533 HD23 HD21 ' A' ' 75' ' ' LEU . 96.1 mt -81.73 136.73 47.88 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.978 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.0 Cg_endo -79.25 171.92 15.45 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.278 2.652 . . . . 0.0 112.941 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.86 -44.59 61.33 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 121.456 -0.402 . . . . 0.0 113.694 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -48.52 -52.75 21.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 122.857 0.463 . . . . 0.0 110.809 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -76.46 -28.18 56.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.234 -177.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' HG12 ' A' ' 34' ' ' VAL . 10.8 mt -60.06 -30.25 69.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.877 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.25 -39.81 96.52 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.822 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 36' ' ' ILE . 24.0 tpp180 -72.61 -42.92 63.97 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 177.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.9 t -57.11 -54.78 25.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.836 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 30' ' ' LEU . 12.0 p -65.72 -29.03 45.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.803 -178.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.84 -42.96 94.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.6 mt -64.6 -43.18 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.263 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' VAL . 49.3 mt -63.22 -62.58 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 22.1 mt-30 -60.83 -36.72 79.82 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -68.86 -46.57 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.423 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.38 -35.23 77.39 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.823 0.344 . . . . 0.0 110.663 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 29.3 mm-40 -114.17 85.04 9.8 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.909 -174.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.35 -13.64 40.87 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.225 1.95 . . . . 0.0 111.789 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -79.2 -5.47 54.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 177.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 51.9 mt -108.91 33.18 4.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.237 0.542 . . . . 0.0 109.739 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -68.19 -17.84 64.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.425 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.44 41.85 1.01 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.203 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.8 m -98.67 88.1 3.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.119 0.485 . . . . 0.0 110.644 178.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 61.7 m-80 -68.87 124.33 90.02 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.802 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 53.8 Cg_exo -55.43 -21.68 31.09 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.429 2.752 . . . . 0.0 114.275 -174.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -72.62 -35.33 67.8 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -144.88 76.56 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.168 -175.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.0 mt -76.02 127.11 37.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.021 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -100.94 129.11 46.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.63 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 32.9 mt -110.23 108.43 25.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.05 102.65 11.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.046 0.927 . . . . 0.0 110.298 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.9 -13.65 61.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.547 -1.206 . . . . 0.0 112.628 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -77.58 -25.58 50.09 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.238 -177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.5 p -91.49 -23.98 19.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 22.9 mt -59.5 130.2 45.71 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.63 176.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 19.8 mttm -73.24 148.49 88.65 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.541 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.41 -34.1 24.62 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.271 1.981 . . . . 0.0 112.248 174.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.3 t -57.12 -55.16 38.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.245 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -60.32 -47.7 84.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.777 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 mt -60.34 -37.08 79.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.117 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.43 -48.02 65.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.572 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -64.16 -44.65 91.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.519 HD22 HG13 ' A' ' 33' ' ' VAL . 94.1 mt -58.43 -56.08 26.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.352 177.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.48 -43.79 75.87 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.087 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -61.0 -41.91 97.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 0.0 111.043 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -71.82 -47.36 53.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.714 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.548 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.5 m -63.75 -38.72 83.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.158 0.504 . . . . 0.0 110.976 -175.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 34.3 p -73.6 -31.61 63.66 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HD2' ' A' ' 77' ' ' LYS . 31.5 t -69.92 -19.41 63.39 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.256 177.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.591 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 38.4 t -90.46 -55.71 3.48 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.39 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.533 HD21 HD23 ' A' ' 25' ' ' LEU . 76.4 mt -77.68 -36.07 51.61 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 39.8 mtp180 -82.06 -6.37 59.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.807 -176.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.488 ' HD2' ' O ' ' A' ' 73' ' ' SER . 54.6 mttm . . . . . 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.204 173.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 34.0 mt . . . . . 0 N--CA 1.456 -0.157 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 19' ' ' SER . 60.6 t -85.23 137.01 21.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.406 -173.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.7 mptp? -119.17 132.75 56.0 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -138.89 145.14 39.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.911 0.386 . . . . 0.0 110.236 174.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 62.8 mttm . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.275 178.251 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.4 m . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.839 0.352 . . . . 0.0 110.358 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -68.95 143.05 94.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.099 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.66 132.39 40.08 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.855 2.37 . . . . 0.0 111.27 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.513 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -65.61 126.52 28.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.267 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 p -72.81 175.13 6.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.67 -49.98 75.63 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.655 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -55.59 -41.95 74.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.197 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.57 -45.79 85.51 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.925 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.513 ' HE3' ' O ' ' A' ' 10' ' ' MET . 92.0 mttt -59.94 -42.24 93.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -63.52 -40.29 96.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.376 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -61.33 -41.05 96.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.719 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.87 -33.43 73.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -179.613 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.492 ' HB2' HG22 ' B' ' 205' ' ' VAL . 80.1 p -68.56 -25.97 65.17 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.509 -0.744 . . . . 0.0 110.016 174.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -86.33 -38.15 17.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.416 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.719 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -68.17 -41.15 81.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.667 176.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.59 -37.8 76.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.077 0.465 . . . . 0.0 110.364 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.32 -33.09 73.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.926 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.1 mttp -62.56 -40.06 95.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.333 0.587 . . . . 0.0 110.469 174.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.623 HD23 HD21 ' A' ' 75' ' ' LEU . 91.4 mt -63.97 133.12 95.48 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.117 -175.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.526 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 85.3 Cg_endo -81.25 171.47 13.8 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.185 2.59 . . . . 0.0 112.951 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.6 -43.58 46.05 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 114.443 0.537 . . . . 0.0 114.443 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.569 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 1.3 mp0 -51.76 -57.19 9.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.625 0.726 . . . . 0.0 110.797 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -71.68 -25.33 62.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.726 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 30' ' ' LEU . 14.7 mt -64.29 -24.05 67.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.009 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.94 -33.79 88.14 Favored Glycine 0 C--N 1.335 0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.103 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -79.17 -38.85 34.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.697 0.284 . . . . 0.0 110.356 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.482 HG13 HD22 ' A' ' 67' ' ' LEU . 60.3 t -59.29 -53.27 50.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.778 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 p -60.51 -33.45 54.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.993 0.425 . . . . 0.0 110.559 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -65.3 -44.44 87.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.173 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -63.47 -46.27 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.469 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.2 mt -60.33 -65.71 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.892 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.471 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 0.0 OUTLIER -58.35 -33.33 69.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -176.589 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 41.1 t -74.27 -27.72 60.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.729 0.299 . . . . 0.0 111.092 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -89.2 -27.37 20.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.063 0.459 . . . . 0.0 110.472 174.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -119.93 87.05 37.67 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.802 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -66.67 -10.64 28.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.167 1.911 . . . . 0.0 111.869 173.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.2 m -85.84 4.44 37.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.8 mt -117.09 47.57 1.47 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 110.588 177.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -90.75 -4.11 56.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.465 0.65 . . . . 0.0 110.037 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -77.66 -13.75 59.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.188 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.471 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.5 m -77.88 86.79 4.1 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.526 176.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -71.24 129.61 88.89 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-N 115.122 -0.944 . . . . 0.0 108.945 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.503 ' HA ' HD11 ' A' ' 52' ' ' ILE . 59.5 Cg_exo -47.58 -25.51 5.46 Favored 'Trans proline' 0 N--CA 1.479 0.675 0 C-N-CA 124.204 3.27 . . . . 0.0 115.083 -174.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -81.69 -23.26 36.95 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.443 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -144.65 77.89 1.55 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.142 0.496 . . . . 0.0 110.173 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.503 HD11 ' HA ' ' A' ' 49' ' ' PRO . 38.9 mt -91.01 129.4 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.437 -175.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.577 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 28.0 mm-40 -103.63 138.53 40.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.468 174.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.2 mt -112.81 108.89 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -111.94 99.0 7.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.06 0.933 . . . . 0.0 110.292 174.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -66.19 -12.64 57.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.129 -174.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.82 -26.97 60.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.913 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.3 p -93.38 -26.32 17.31 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.47 132.4 53.87 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.132 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mtmm -81.12 149.75 66.9 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.444 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.82 -41.59 11.82 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.956 2.438 . . . . 0.0 112.867 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -53.05 -54.08 40.7 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.716 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.5 m -61.31 -48.11 82.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.832 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.6 mt -58.01 -35.42 71.23 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.14 0.495 . . . . 0.0 110.976 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.64 -46.09 48.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.783 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -64.78 -42.88 94.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.644 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 71' ' ' VAL . 87.7 mt -57.38 -56.74 17.96 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.568 177.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -55.4 -44.27 76.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.37 -37.77 78.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 110.912 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -78.39 -47.32 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.016 -177.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.61 HG12 HD11 ' A' ' 25' ' ' LEU . 15.4 m -61.46 -41.82 91.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.139 0.495 . . . . 0.0 110.399 -176.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 24.9 p -65.66 -35.72 81.59 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.932 -178.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.9 p -68.49 -23.24 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.853 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.4 t -91.4 -29.54 17.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.87 0.367 . . . . 0.0 110.704 -179.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.623 HD21 HD23 ' A' ' 25' ' ' LEU . 34.8 mt -101.64 -37.1 8.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -80.89 -3.21 50.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.264 0.554 . . . . 0.0 110.633 -177.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.5 tttt . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.076 170.863 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 45.8 mm . . . . . 0 N--CA 1.453 -0.305 0 CA-C-O 120.971 0.415 . . . . 0.0 109.903 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 3.5 t -95.69 147.74 5.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.002 -177.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.577 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.8 ttmm -139.09 112.77 8.38 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.48 ' CE1' HD12 ' A' ' 52' ' ' ILE . 30.0 p90 -132.51 136.14 46.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.367 0.603 . . . . 0.0 111.017 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.346 179.766 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.57 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 77.2 m . . . . . 0 C--O 1.235 0.311 0 CA-C-O 121.107 0.479 . . . . 0.0 111.694 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -68.83 144.43 95.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.212 173.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.4 130.6 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.841 2.361 . . . . 0.0 111.746 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.589 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 25.8 mmt -65.88 135.39 54.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.878 -175.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 p -84.14 178.33 7.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.883 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.02 -50.02 75.68 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 117.672 0.215 . . . . 0.0 110.646 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -53.95 -41.66 68.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.231 0.539 . . . . 0.0 111.102 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.16 -46.86 69.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.589 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.9 mttt -60.46 -36.99 79.57 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.402 177.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -65.05 -41.82 94.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.683 0.278 . . . . 0.0 110.307 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.97 -42.88 99.16 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.97 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.736 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -67.92 -32.13 72.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.289 -177.832 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB2' HG22 ' B' ' 205' ' ' VAL . 83.1 p -69.53 -26.86 64.72 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 173.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 82.8 mt -82.93 -46.14 13.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.057 -178.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.736 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -60.46 -41.86 94.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.848 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HA ' HD12 ' A' ' 25' ' ' LEU . 34.8 mt -61.34 -42.02 92.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.815 0.341 . . . . 0.0 110.682 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -70.19 -25.87 63.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 0.0 111.212 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 52.1 mtpt -78.92 -19.62 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.993 0.425 . . . . 0.0 110.59 178.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.608 HD23 HD21 ' A' ' 75' ' ' LEU . 93.9 mt -75.0 138.64 72.74 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.238 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 97.4 Cg_endo -79.93 172.03 14.58 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 123.238 2.625 . . . . 0.0 112.954 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.2 -44.44 57.51 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.381 -0.438 . . . . 0.0 113.427 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -47.8 -54.27 12.89 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.325 0.583 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.658 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -79.87 -31.89 40.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.996 -175.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 6.2 mt -61.81 -27.16 68.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.595 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.13 -35.91 79.54 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.867 173.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.463 ' O ' HG13 ' A' ' 36' ' ' ILE . 18.8 tpp180 -79.24 -44.31 22.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.478 0.18 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.548 HG13 HD22 ' A' ' 67' ' ' LEU . 42.8 t -55.16 -52.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.659 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.28 -31.63 53.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.79 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.0 t60 -69.57 -41.13 76.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.96 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.711 HD13 ' HG3' ' A' ' 66' ' ' GLU . 55.6 mt -64.67 -43.0 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.139 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 33' ' ' VAL . 52.3 mt -62.56 -59.25 4.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.476 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.533 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 31.3 mt-30 -61.69 -31.81 71.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 t -77.02 -47.81 19.64 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.162 -0.336 . . . . 0.0 111.183 -177.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -67.64 -29.99 69.45 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.97 0.414 . . . . 0.0 110.279 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.448 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 33.8 mm-40 -113.32 83.41 6.6 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.096 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -65.52 -15.85 51.38 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.024 1.816 . . . . 0.0 111.287 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.2 m -73.25 -13.87 61.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.55 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 64.0 mt -110.21 27.0 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.097 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -62.1 -32.69 73.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.254 -176.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -88.9 42.88 1.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.153 0.501 . . . . 0.0 110.804 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.533 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.2 m -76.04 92.1 3.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.979 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 27.6 m-80 -52.54 116.99 9.73 Favored Pre-proline 0 CA--C 1.519 -0.223 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.704 177.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.2 Cg_exo -54.85 -30.35 67.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.113 2.542 . . . . 0.0 113.422 -173.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -76.69 -24.15 53.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.143 -178.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -140.28 72.95 1.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.2 mt -87.81 125.73 41.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.936 0.398 . . . . 0.0 111.198 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -106.4 117.53 34.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.43 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 59.4 mt -93.83 109.12 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 173.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -110.64 100.66 9.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.937 0.875 . . . . 0.0 110.629 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -66.98 -6.89 18.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.505 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -81.71 -27.89 33.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.718 0.294 . . . . 0.0 111.209 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.4 -24.38 18.09 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.448 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 36.9 mt -61.04 123.27 17.15 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.618 176.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.8 mptt -69.92 148.21 96.22 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.653 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -44.75 -33.59 7.29 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.507 2.138 . . . . 0.0 113.257 175.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.2 t -60.84 -46.7 89.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.496 0.189 . . . . 0.0 110.726 178.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.5 m -65.38 -48.11 74.02 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.76 -37.85 74.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.832 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.57 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 8.7 tpt180 -71.5 -49.48 40.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.828 178.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.711 ' HG3' HD13 ' A' ' 36' ' ' ILE . 6.8 tp10 -56.28 -48.43 76.63 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.175 0.512 . . . . 0.0 110.164 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 96.1 mt -57.14 -58.24 9.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.312 178.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' VAL . 28.8 tt0 -55.04 -47.85 74.23 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.947 0.403 . . . . 0.0 111.004 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -58.04 -36.34 72.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.63 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -80.06 -46.07 17.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.835 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.576 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.0 m -64.1 -39.41 85.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.14 0.495 . . . . 0.0 110.636 -175.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.583 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 23.9 p -72.14 -34.0 68.2 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.532 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.5 p -67.98 -17.71 64.52 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.204 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.658 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.7 t -91.41 -54.26 3.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.663 177.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.608 HD21 HD23 ' A' ' 25' ' ' LEU . 65.7 mt -77.03 -30.34 55.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -173.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.583 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.8 mtp180 -82.09 -5.12 58.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.148 0.499 . . . . 0.0 110.297 177.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 C--N 1.324 -0.513 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.367 174.464 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 pt . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.956 0.408 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . 0.456 HG22 ' HB2' ' A' ' 19' ' ' SER . 12.5 t -95.73 117.19 39.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.174 -177.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 26.9 mttm -106.26 89.02 2.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -101.0 137.29 39.56 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.459 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 92.4 mttt . . . . . 0 C--N 1.317 -0.83 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.039 -177.602 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.1 m . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 120.829 0.347 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -69.75 146.67 95.87 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.84 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.01 126.24 19.78 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.865 2.377 . . . . 0.0 112.173 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . 0.412 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 24.6 mmt -57.08 134.77 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.703 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 m -88.67 174.77 7.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.51 -54.92 40.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -165.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -51.65 -40.06 59.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.657 0.265 . . . . 0.0 111.695 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.66 -47.33 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.491 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.5 mttt -58.52 -41.96 86.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.943 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.44 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 ttp180 -63.48 -46.63 85.29 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.334 177.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -50.92 71.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.412 178.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 95.7 p -58.74 -37.02 75.29 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.975 0.417 . . . . 0.0 110.866 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 98.1 mt -70.3 -40.52 74.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.653 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.546 ' O ' HD11 ' A' ' 75' ' ' LEU . 63.7 m-20 -67.25 -37.2 83.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.28 -40.11 86.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.898 0.38 . . . . 0.0 110.719 176.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -72.23 -28.96 63.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.098 0.475 . . . . 0.0 110.563 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.653 ' HD3' HD13 ' A' ' 75' ' ' LEU . 46.6 mttp -62.13 -39.0 91.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.692 171.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD23 HD21 ' A' ' 75' ' ' LEU . 96.0 mt -64.47 141.43 98.21 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.787 -175.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.4 Cg_endo -82.77 172.08 11.41 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.479 2.786 . . . . 0.0 112.717 178.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.11 -39.41 63.57 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.886 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 6.5 mp0 -48.34 -59.53 3.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.73 0.776 . . . . 0.0 111.171 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.7 mptp? -77.42 -29.32 52.92 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.022 -176.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.6 -29.85 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.801 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.8 -35.06 80.45 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.84 175.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -80.69 -38.92 28.09 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 122.749 -0.266 . . . . 0.0 110.748 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.441 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -55.34 -53.76 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 110.548 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.5 p -63.78 -30.92 51.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.672 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -66.59 -41.26 88.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.101 177.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 66.0 mt -63.08 -43.17 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.048 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.462 HD13 HG23 ' A' ' 54' ' ' ILE . 47.4 mt -64.39 -62.29 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.937 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -60.67 -35.43 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.2 t -74.02 -36.81 64.47 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.264 -176.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 11.0 mpt_? -77.73 -31.84 52.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.271 176.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.439 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 21.0 mm-40 -117.91 86.37 25.04 Favored Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.473 -176.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.26 -9.72 24.79 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.299 1.999 . . . . 0.0 112.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.4 m -84.47 -3.87 58.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 110.393 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.8 mt -114.29 29.29 8.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.522 0.677 . . . . 0.0 109.325 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -82.19 -9.96 59.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 -172.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -100.6 24.12 9.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.379 0.609 . . . . 0.0 110.355 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.6 p -77.87 103.35 7.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.337 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -57.61 119.72 35.28 Favored Pre-proline 0 CA--C 1.52 -0.192 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.804 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HA ' HD11 ' A' ' 52' ' ' ILE . 86.4 Cg_exo -51.59 -25.31 19.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 123.546 2.83 . . . . 0.0 113.832 -176.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.595 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 18.5 m-20 -77.67 -28.33 51.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.433 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -143.03 76.64 1.54 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 49' ' ' PRO . 41.9 mt -87.97 129.51 39.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.069 -176.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.421 ' HG3' ' HD3' ' B' ' 206' ' ' LYS . 2.2 mp0 -108.44 123.93 49.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.214 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . 0.462 HG23 HD13 ' A' ' 37' ' ' ILE . 17.9 mt -95.74 108.67 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 175.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 13.0 p-10 -104.06 97.65 7.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.008 0.908 . . . . 0.0 110.852 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -71.57 -0.42 10.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.983 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -84.93 -22.13 29.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.84 0.352 . . . . 0.0 110.582 -178.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.7 p -102.52 -25.02 13.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.978 0.418 . . . . 0.0 110.078 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 37.7 mt -57.06 131.83 51.08 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.784 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -75.89 150.55 83.79 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.32 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -45.8 -41.63 19.82 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 113.31 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.8 p -57.72 -48.11 80.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -62.82 -47.51 83.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.157 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.445 HD21 ' HB2' ' A' ' 59' ' ' LEU . 83.0 mt -57.96 -40.59 80.93 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.987 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -68.36 -46.52 69.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.271 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -68.13 -39.71 82.67 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.065 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 71' ' ' VAL . 82.3 mt -57.04 -54.16 49.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 174.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -57.46 -47.72 81.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.514 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -63.76 -27.78 69.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.159 -176.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -79.43 -51.67 9.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.11 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.614 HG13 ' O ' ' A' ' 67' ' ' LEU . 5.3 m -66.79 -36.24 76.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.712 0.291 . . . . 0.0 110.878 -173.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.1 p -72.37 -38.28 68.57 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.638 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.1 p -62.18 -24.19 67.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.443 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 27.7 t -91.03 -49.95 6.13 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.507 -179.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.653 HD13 ' HD3' ' A' ' 24' ' ' LYS . 71.9 mt -83.23 -21.19 33.47 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -172.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 72' ' ' THR . 35.2 mtp180 -85.96 0.54 52.98 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.412 0.625 . . . . 0.0 109.789 175.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.9 tttm . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.673 169.437 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 46.8 mm . . . . . 0 C--O 1.233 0.205 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.6 t -91.74 109.75 21.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.885 0.374 . . . . 0.0 110.657 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 206' ' ' LYS . . . . . 0.421 ' HD3' ' HG3' ' A' ' 53' ' ' GLU . 8.3 tppt? -99.18 83.56 2.88 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 175.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -99.09 158.29 15.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.116 0.484 . . . . 0.0 110.637 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 208' ' ' LYS . . . . . 0.595 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 44.4 tttp . . . . . 0 C--N 1.321 -0.644 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.233 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 120.762 0.315 . . . . 0.0 111.558 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -99.28 -44.23 6.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.25 0.548 . . . . 0.0 110.942 178.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -60.48 -55.67 30.66 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.166 -0.924 . . . . 0.0 112.101 -173.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -73.31 -21.66 60.52 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.206 0.527 . . . . 0.0 110.703 -175.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -75.53 -25.61 57.34 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.774 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -95.57 -43.19 8.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.339 177.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.3 m -105.42 101.01 10.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.358 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -75.77 147.09 80.77 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.653 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.5 146.8 96.71 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 123.4 2.734 . . . . 0.0 112.906 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.425 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.72 129.08 34.17 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.879 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 21.0 p -72.55 177.45 4.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 177.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 202' ' ' SER . 2.4 t80 -60.7 -46.74 89.22 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.014 -177.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -54.19 -44.26 71.43 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.015 178.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -61.39 -46.77 88.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.464 177.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.425 ' HE3' ' O ' ' A' ' 10' ' ' MET . 90.7 mttt -62.41 -34.21 76.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.549 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.9 ttp85 -68.42 -40.96 81.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.973 0.416 . . . . 0.0 110.08 174.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.44 -49.08 79.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.022 178.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.773 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -63.19 -34.83 78.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.214 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.3 t -63.91 -34.18 77.38 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.048 0.452 . . . . 0.0 110.449 173.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.9 mt -79.26 -41.47 28.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.438 -178.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.773 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.9 p30 -65.77 -42.91 90.24 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.143 178.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 45.1 mt -59.33 -37.32 68.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.118 0.485 . . . . 0.0 110.347 177.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -71.34 -23.92 62.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.626 -179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 51.2 mtpt -83.45 -14.25 52.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.054 0.454 . . . . 0.0 110.281 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.532 HD11 HG12 ' A' ' 71' ' ' VAL . 92.2 mt -79.76 137.73 54.37 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.109 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 95.1 Cg_endo -80.98 172.55 12.92 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 123.183 2.589 . . . . 0.0 113.156 179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.84 -44.64 49.34 Favored Glycine 0 CA--C 1.519 0.321 0 O-C-N 123.361 0.413 . . . . 0.0 113.701 -175.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 15.6 mp0 -50.16 -57.84 6.86 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.394 0.616 . . . . 0.0 111.175 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.644 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -74.17 -25.53 59.77 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.182 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -61.55 -26.89 68.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.124 176.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.424 ' HA2' ' HD2' ' B' ' 209' ' ' LYS . . . -63.66 -36.44 93.34 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.208 175.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -76.61 -37.57 56.21 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.267 177.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.499 HG13 HD22 ' A' ' 67' ' ' LEU . 57.4 t -59.09 -54.83 28.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.619 177.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.43 HG21 HD13 ' A' ' 52' ' ' ILE . 15.0 p -63.43 -28.72 45.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.832 0.349 . . . . 0.0 110.533 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -67.46 -42.17 83.48 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.216 177.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 74.0 mt -66.69 -46.35 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 33' ' ' VAL . 57.1 mt -60.1 -55.63 22.88 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.44 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 47' ' ' SER . 4.0 mt-30 -61.38 -40.98 96.32 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -176.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.5 t -74.28 -30.21 61.99 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.305 -0.247 . . . . 0.0 111.539 -175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.414 ' HD3' ' OE2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -82.3 -28.86 31.46 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.544 -0.463 . . . . 0.0 110.313 174.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -116.23 83.34 12.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.716 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -63.58 -16.01 52.07 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.41 2.074 . . . . 0.0 112.783 -178.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 35.2 t -74.01 -22.36 59.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.219 0.533 . . . . 0.0 109.952 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 72.2 mt -96.42 25.98 4.67 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.395 -178.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -63.12 -25.05 68.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.842 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -89.46 36.92 0.85 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.459 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.493 ' HB2' HE21 ' A' ' 38' ' ' GLN . 70.1 m -80.12 88.83 5.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 174.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 90.9 m-20 -62.61 124.5 83.27 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.965 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 89.4 Cg_exo -53.01 -23.09 20.5 Favored 'Trans proline' 0 CA--C 1.533 0.474 0 C-N-CA 123.463 2.775 . . . . 0.0 113.904 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.08 -23.37 48.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 111.491 0.182 . . . . 0.0 111.491 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -147.66 72.62 1.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.259 0.224 . . . . 0.0 110.792 -174.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.43 HD13 HG21 ' A' ' 34' ' ' VAL . 23.0 mt -90.95 122.12 42.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.533 178.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -99.9 140.61 33.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.639 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 49.3 mt -112.54 107.69 23.63 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 172.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.51 92.66 4.14 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 122.23 1.014 . . . . 0.0 110.103 176.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -61.52 -15.93 42.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.391 -1.277 . . . . 0.0 112.229 -174.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -75.15 -22.32 58.2 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.495 -174.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.9 p -96.9 -26.72 14.97 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.0 mt -58.61 123.88 17.8 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.848 177.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.06 150.64 97.47 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.636 176.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -46.61 -29.5 7.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.483 2.122 . . . . 0.0 112.542 173.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.7 t -56.73 -55.36 35.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 176.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -63.77 -46.16 86.52 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.414 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -59.17 -37.2 76.77 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.093 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -73.25 -45.08 57.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.973 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.414 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 29.9 mt-10 -66.47 -38.29 87.0 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.679 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.527 ' O ' HG13 ' A' ' 71' ' ' VAL . 77.3 mt -60.36 -56.83 16.69 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.363 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 71' ' ' VAL . 18.1 tt0 -55.36 -41.83 73.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.884 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -58.43 -36.96 74.43 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.302 0.572 . . . . 0.0 110.534 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -82.77 -45.74 14.0 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.87 -175.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.586 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.4 m -63.19 -36.01 74.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.04 0.448 . . . . 0.0 110.403 -177.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 30.6 p -71.75 -39.95 69.69 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.335 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.7 p -64.82 -21.56 66.81 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.611 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.644 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 29.3 t -91.14 -53.14 4.49 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.762 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.521 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -79.51 -35.68 39.7 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 113.059 0.762 . . . . 0.0 113.059 -171.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.524 ' HB2' ' O ' ' A' ' 72' ' ' THR . 95.2 mtt180 -67.89 -31.43 71.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -83.84 -49.85 8.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.033 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -128.01 97.78 4.91 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.014 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -67.32 -21.9 65.64 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.499 . . . . 0.0 110.774 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -134.36 86.17 36.26 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.12 175.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.29 -12.92 36.42 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.864 2.376 . . . . 0.0 111.815 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.481 HE21 ' HB3' ' A' ' 26' ' ' PRO . 10.5 pt20 -117.13 159.9 21.87 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.217 174.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.156 0 CA-C-O 118.287 -0.863 . . . . 0.0 110.799 -177.524 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.709 0.29 . . . . 0.0 110.88 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 93.7 mt -75.56 121.12 21.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.346 178.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -64.15 99.45 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.127 178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . 0.504 ' HA ' ' OH ' ' A' ' 12' ' ' TYR . 26.8 m -100.1 164.73 11.85 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.587 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 7.4 p -73.21 74.85 1.3 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.581 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 47.5 mm -76.88 120.01 26.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 174.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.407 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 4.4 t -100.81 149.87 5.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.13 -172.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -134.17 127.89 32.92 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 172.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 19.0 p90 -140.64 151.6 44.73 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.198 -0.601 . . . . 0.0 111.149 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -97.5 131.59 43.98 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.287 175.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . 0.424 ' HD2' ' HA2' ' A' ' 31' ' ' GLY . 17.3 ttpp -113.58 119.2 42.07 Favored Pre-proline 0 C--N 1.318 -0.776 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.73 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -58.17 147.0 86.11 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 122.606 2.204 . . . . 0.0 111.625 173.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 76.4 mt 66.67 95.56 0.05 OUTLIER Pre-proline 0 C--O 1.235 0.315 0 O-C-N 123.871 0.732 . . . . 0.0 111.41 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.54 80.4 2.3 Favored 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 122.459 2.106 . . . . 0.0 112.144 178.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 33.8 tp -71.95 -37.51 69.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.151 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 27.5 p -96.95 75.06 2.64 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.003 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -108.81 108.12 60.53 Favored Pre-proline 0 C--N 1.322 -0.614 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.82 151.89 81.52 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.568 2.179 . . . . 0.0 112.606 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.414 -1.215 . . . . 0.0 111.858 179.586 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 120.696 0.284 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -76.09 -4.85 43.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.43 -176.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -61.85 -48.87 78.59 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.381 -179.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.25 -26.93 65.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.977 0.418 . . . . 0.0 110.492 -176.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -67.11 -30.94 71.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.0 -177.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -109.28 -29.82 8.3 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.947 0.403 . . . . 0.0 111.019 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.495 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 62.5 m -109.93 99.58 8.68 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.959 -177.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -81.78 149.79 64.55 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.988 176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -62.79 135.63 53.19 Favored 'Trans proline' 0 C--O 1.233 0.275 0 C-N-CA 123.185 2.59 . . . . 0.0 112.42 -176.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -70.04 135.02 48.87 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.704 -177.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.5 p -76.76 176.18 8.71 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -61.86 -46.85 87.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 120.126 -0.63 . . . . 0.0 110.372 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -54.84 -44.66 74.13 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.112 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -64.7 -46.23 83.23 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.186 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -58.03 -44.24 87.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.179 176.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -63.86 -43.09 97.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.875 0.369 . . . . 0.0 110.275 177.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -57.62 -47.27 82.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.186 176.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.5 -48.07 83.07 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.036 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.649 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 59.7 p -60.87 -35.87 77.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.796 -179.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.5 mt -72.9 -35.93 67.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.954 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.516 ' O ' HD11 ' A' ' 75' ' ' LEU . 1.1 m-20 -70.05 -42.23 73.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.427 177.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.409 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.1 mt -56.72 -38.22 56.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.318 0.58 . . . . 0.0 110.646 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -69.1 -25.25 64.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.576 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -82.11 -15.75 52.34 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.057 0.456 . . . . 0.0 110.637 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.473 HD23 HD21 ' A' ' 75' ' ' LEU . 92.1 mt -77.41 134.4 66.5 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.531 -176.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.504 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 92.1 Cg_endo -80.45 171.27 14.97 Favored 'Trans proline' 0 C--O 1.237 0.427 0 C-N-CA 123.042 2.495 . . . . 0.0 113.252 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.3 -46.24 44.15 Favored Glycine 0 CA--C 1.52 0.365 0 O-C-N 123.377 0.423 . . . . 0.0 114.048 -173.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -47.75 -51.99 20.21 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.09 0.471 . . . . 0.0 111.684 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.56 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.8 mptp? -79.64 -30.13 41.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.088 -174.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.6 mt -62.48 -27.07 68.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.665 177.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.52 -31.27 79.13 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.058 -0.591 . . . . 0.0 112.177 174.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.412 ' O ' HG13 ' A' ' 36' ' ' ILE . 17.1 tpp180 -81.69 -41.69 20.96 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.799 -0.236 . . . . 0.0 110.377 177.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.548 ' O ' HG13 ' A' ' 37' ' ' ILE . 80.2 t -56.22 -54.12 31.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.84 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.1 -31.46 53.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.582 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -65.64 -41.68 92.34 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.867 177.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.2 mt -64.25 -50.98 74.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.107 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 33' ' ' VAL . 43.2 mt -56.24 -59.88 2.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.161 -178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -63.14 -34.4 77.53 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.8 m -77.69 -33.08 53.38 Favored 'General case' 0 N--CA 1.446 -0.641 0 O-C-N 122.026 -0.421 . . . . 0.0 111.754 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -77.13 -30.12 55.0 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.093 0.473 . . . . 0.0 109.966 174.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 35.0 mm-40 -115.52 84.23 11.91 Favored Pre-proline 0 N--CA 1.446 -0.665 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.41 -178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.48 -13.97 40.89 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.398 2.066 . . . . 0.0 112.352 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.2 t -79.56 -11.15 59.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.134 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 68.0 mt -105.76 32.29 4.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.434 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -80.99 -1.76 45.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.235 0.54 . . . . 0.0 110.496 -177.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -97.4 17.13 18.19 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.682 0.754 . . . . 0.0 109.659 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.9 m -75.86 95.74 3.57 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.903 178.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -54.82 122.9 43.31 Favored Pre-proline 0 C--N 1.331 -0.205 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 173.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.19 -16.88 23.41 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.889 2.393 . . . . 0.0 112.459 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -82.55 -36.79 25.97 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.247 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -131.92 62.02 1.64 Allowed 'General case' 0 C--O 1.233 0.191 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.894 -176.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.505 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 24.0 mt -74.0 119.69 21.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.173 0.511 . . . . 0.0 111.458 -175.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -103.99 131.37 51.3 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.202 -0.908 . . . . 0.0 109.342 178.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 39.8 mt -106.87 109.67 28.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 110.508 -0.182 . . . . 0.0 110.508 177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.27 101.92 11.44 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.101 0.953 . . . . 0.0 110.543 176.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -71.81 -6.9 44.9 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.864 -1.062 . . . . 0.0 112.312 -172.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -78.74 -30.54 45.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.767 0.317 . . . . 0.0 110.765 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.5 p -90.16 -26.07 20.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.95 177.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.45 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 38.4 mt -59.32 127.38 31.8 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.637 176.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.3 mptt -72.91 148.17 89.21 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.854 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -43.79 -36.2 7.51 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 122.567 2.178 . . . . 0.0 113.201 175.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.492 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 33.5 t -54.6 -56.96 13.51 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 175.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.401 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.2 m -59.18 -47.8 83.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.456 -179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' A' ' 59' ' ' LEU . 87.5 mt -57.18 -40.37 77.21 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.115 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 18.3 tpt180 -71.1 -46.92 60.83 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.023 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 62' ' ' SER . 41.5 mt-10 -65.61 -38.64 90.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.408 . . . . 0.0 110.458 -177.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.537 ' O ' HG13 ' A' ' 71' ' ' VAL . 93.2 mt -62.0 -55.97 23.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.244 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -53.83 -47.21 71.16 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.484 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 69' ' ' ARG . 35.2 ttp180 -52.7 -42.45 64.84 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.329 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 73.8 t80 -79.48 -47.84 14.93 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.832 -174.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.1 m -63.79 -35.33 72.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.955 0.407 . . . . 0.0 110.381 -176.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 40.6 p -75.73 -36.69 59.85 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.828 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.3 p -66.56 -19.32 65.75 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.749 0.309 . . . . 0.0 110.601 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.56 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 24.4 t -90.44 -51.1 5.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.609 178.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.516 HD11 ' O ' ' A' ' 21' ' ' ASP . 81.3 mt -79.87 -36.8 36.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -173.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 46.1 mtp180 -79.18 -4.74 51.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.105 0.479 . . . . 0.0 110.711 -179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -102.16 -34.22 9.36 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 172.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -148.57 105.77 3.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.412 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -54.18 -38.14 65.26 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.962 -174.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -127.38 96.46 33.43 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 172.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.415 ' HB3' ' HE3' ' A' ' 29' ' ' LYS . 49.5 Cg_exo -56.31 115.03 2.18 Favored 'Trans proline' 0 C--O 1.235 0.34 0 C-N-CA 122.969 2.446 . . . . 0.0 112.65 -178.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -138.17 127.76 24.99 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.027 -178.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.884 0 CA-C-O 118.434 -0.793 . . . . 0.0 109.845 177.898 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.407 0.146 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -139.23 156.43 47.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.773 0.32 . . . . 0.0 110.423 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -100.67 90.43 4.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 19.2 m -74.76 159.81 31.51 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.002 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 14.9 m -81.0 83.54 6.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.53 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 44.3 mm -75.1 133.11 32.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.08 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.649 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 88.8 t -104.88 122.91 58.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.419 -177.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 16.5 ttmm -107.09 117.34 33.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.507 171.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.9 p90 -127.79 141.88 51.46 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.538 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 27.0 mtpp -96.24 126.67 41.62 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.695 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -114.06 84.03 8.53 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.143 -177.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.538 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 5.2 Cg_exo -78.51 115.59 3.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.282 2.655 . . . . 0.0 113.086 -175.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 50.7 tp -116.37 110.78 42.62 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.527 175.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -68.59 103.72 1.02 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.439 2.093 . . . . 0.0 112.414 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 80.5 mt -87.21 -15.99 36.62 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.132 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 5.5 p -73.76 86.13 1.68 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.593 176.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -138.45 122.3 11.41 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.943 -177.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 178.65 7.2 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.389 2.059 . . . . 0.0 111.7 177.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.053 -1.415 . . . . 0.0 111.179 178.961 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.476 0.861 0 CA-C-O 120.541 0.21 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -98.72 -32.7 11.25 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -177.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.46 -43.03 82.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.513 0.197 . . . . 0.0 110.545 -175.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -73.23 -16.68 61.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.761 0.315 . . . . 0.0 110.997 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -78.59 -43.85 25.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 175.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' HE2' ' SG ' ' A' ' 7' ' ' CYS . 0.4 OUTLIER -71.38 -49.64 40.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.209 178.494 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.496 ' SG ' ' HE2' ' A' ' 6' ' ' LYS . 55.8 m -99.0 98.02 9.11 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.291 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -85.03 154.33 60.55 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.609 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.59 128.92 24.77 Favored 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 123.172 2.581 . . . . 0.0 112.14 -176.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.457 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -61.34 130.06 44.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.189 177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 31.8 p -73.65 173.88 9.13 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -59.75 -47.3 86.23 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.725 -174.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -53.7 -41.95 67.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.489 . . . . 0.0 111.081 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -67.56 -46.96 71.19 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.121 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.3 mttt -58.73 -42.22 88.24 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.259 178.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 38.0 ttp180 -62.0 -44.41 96.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.909 0.385 . . . . 0.0 110.336 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.8 tt0 -56.99 -41.41 78.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.426 179.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.842 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 1.5 mt -67.0 -36.04 81.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.859 -176.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 79.4 p -65.74 -29.13 69.61 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.867 175.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.22 -42.41 31.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.842 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.4 p30 -67.85 -45.67 73.94 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.196 -0.201 . . . . 0.0 110.974 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 36.0 mt -57.25 -34.21 45.27 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 121.365 0.603 . . . . 0.0 110.17 177.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -71.39 -29.37 64.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.434 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.424 ' HB2' ' CD1' ' A' ' 75' ' ' LEU . 55.4 mtpt -78.92 -22.37 45.91 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.035 0.445 . . . . 0.0 110.568 178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.555 HD23 HD21 ' A' ' 75' ' ' LEU . 86.6 mt -72.51 138.76 80.79 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.521 -178.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 48.9 Cg_endo -83.81 172.63 9.85 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.475 2.783 . . . . 0.0 112.799 178.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -53.03 -44.38 62.32 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.548 -0.358 . . . . 0.0 113.466 -176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.55 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.3 mp0 -46.52 -52.06 14.14 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.615 0.721 . . . . 0.0 111.31 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.565 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.2 mptp? -83.51 -25.7 30.85 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.816 -175.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.5 mt -64.07 -27.08 68.86 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.311 177.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.78 92.08 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.046 -0.597 . . . . 0.0 111.625 174.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -76.74 -42.86 39.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.561 0.22 . . . . 0.0 110.72 177.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.55 HG13 HD22 ' A' ' 67' ' ' LEU . 59.9 t -56.12 -52.07 54.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.961 0.41 . . . . 0.0 110.731 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.478 HG21 HD13 ' A' ' 52' ' ' ILE . 8.0 p -65.14 -32.25 57.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.625 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -63.61 -42.43 98.22 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 79.3 mt -62.79 -49.06 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.316 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mt -61.51 -56.97 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.944 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 92.1 mt-30 -61.51 -32.97 73.03 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.9 t -80.16 -37.2 33.89 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.219 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.581 ' HD3' ' OE1' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -72.8 -35.6 67.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 120.972 0.415 . . . . 0.0 110.172 175.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.521 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 25.4 mm-40 -114.12 84.63 9.26 Favored Pre-proline 0 N--CA 1.442 -0.833 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.969 -175.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.2 -13.31 39.32 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.334 2.023 . . . . 0.0 112.33 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.0 m -79.06 -7.2 57.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.238 0.542 . . . . 0.0 110.353 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -110.88 25.62 11.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.32 178.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.77 -16.13 60.16 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.912 0.387 . . . . 0.0 110.844 -175.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.72 28.14 1.6 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.86 0.362 . . . . 0.0 111.061 177.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.1 p -80.05 97.71 6.93 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -57.3 123.93 63.79 Favored Pre-proline 0 CA--C 1.516 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -54.95 -21.23 25.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 123.075 2.517 . . . . 0.0 113.15 -178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.61 -22.08 37.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.06 177.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.7 mm-40 -143.64 75.41 1.47 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.307 -176.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.478 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -92.05 121.81 42.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.648 0.261 . . . . 0.0 111.091 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -104.21 137.34 42.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.737 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 54.2 mt -110.83 109.98 30.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.632 0.253 . . . . 0.0 110.58 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -110.53 98.78 7.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.933 0.873 . . . . 0.0 110.474 174.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -64.66 -16.36 62.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.783 -1.099 . . . . 0.0 112.582 -173.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -74.16 -27.51 60.87 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.659 -176.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.08 -26.63 17.38 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.921 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.8 mt -56.53 128.64 37.19 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.238 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.521 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 24.0 mttm -70.84 149.23 95.05 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.822 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -46.46 -38.84 21.72 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.16 1.907 . . . . 0.0 112.35 174.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.8 m -56.61 -50.45 71.96 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.992 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.3 m -62.14 -48.22 81.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.395 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.5 mt -58.02 -34.96 70.6 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.847 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -73.76 -50.54 20.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.128 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.581 ' OE1' ' HD3' ' A' ' 40' ' ' ARG . 40.9 mt-10 -62.41 -40.76 97.59 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.712 0.292 . . . . 0.0 110.779 -178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.599 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.2 mt -57.1 -60.35 3.73 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.357 176.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.629 ' OE2' HG23 ' A' ' 72' ' ' THR . 6.1 tp10 -51.92 -52.35 50.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.346 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -55.9 -36.5 67.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.051 0.453 . . . . 0.0 110.941 -177.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -77.13 -48.19 18.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.845 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -63.55 -36.19 75.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.825 0.345 . . . . 0.0 110.62 -175.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.629 HG23 ' OE2' ' A' ' 68' ' ' GLU . 0.9 OUTLIER -67.74 -39.26 84.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.936 178.62 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.1 p -65.62 -23.15 66.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.812 0.339 . . . . 0.0 110.573 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.565 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 49.1 t -90.01 -47.11 8.05 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.973 179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.555 HD21 HD23 ' A' ' 25' ' ' LEU . 74.8 mt -87.8 -44.17 11.31 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -173.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 72' ' ' THR . 90.4 mtt180 -66.83 -26.03 66.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.803 0.335 . . . . 0.0 111.208 -176.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -94.1 2.07 56.05 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.17 178.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -141.23 -144.3 0.16 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 179.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.417 ' HG3' ' N ' ' A' ' 80' ' ' LYS . 30.9 ptt180 -150.71 -51.73 0.13 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.627 0.251 . . . . 0.0 110.533 176.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.417 ' N ' ' HG3' ' A' ' 79' ' ' ARG . 54.9 tttm 178.33 122.91 0.2 Allowed Pre-proline 0 C--N 1.328 -0.352 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 -177.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.457 ' HG2' ' HG3' ' A' ' 26' ' ' PRO . 76.8 Cg_exo -48.63 111.87 0.53 Allowed 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.963 2.442 . . . . 0.0 112.383 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.54 -52.88 15.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.262 -177.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.241 178.916 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 . . . . . 0 N--CA 1.484 1.262 0 CA-C-O 120.827 0.346 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 56.3 tp -132.18 -48.11 0.92 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.907 0.384 . . . . 0.0 110.423 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -158.01 96.27 1.45 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.404 0.621 . . . . 0.0 111.051 -178.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 51.5 m -87.57 56.47 3.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.107 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 37.4 m 61.31 57.96 2.28 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.732 176.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.438 HD12 ' N ' ' B' ' 204' ' ' ILE . 2.3 mp -79.4 108.85 13.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 175.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.33 163.24 2.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.158 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 0.0 OUTLIER -159.24 141.85 14.03 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.114 169.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -140.93 159.62 41.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.896 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -104.98 128.86 53.46 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 177.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -119.86 85.82 34.82 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.053 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -61.62 -52.26 3.28 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.559 2.173 . . . . 0.0 111.254 176.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 33.7 tp 48.59 70.16 2.26 Favored Pre-proline 0 N--CA 1.465 0.286 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.169 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_exo -62.64 143.65 92.87 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.513 2.142 . . . . 0.0 111.708 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 8.6 mp 59.93 53.91 4.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.814 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 91.6 m -65.61 -37.1 85.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.412 0.625 . . . . 0.0 109.685 176.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -80.99 143.19 52.82 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.739 177.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.06 59.87 5.34 Favored 'Trans proline' 0 C--O 1.233 0.266 0 C-N-CA 122.629 2.219 . . . . 0.0 112.275 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.928 0 CA-C-O 118.753 -1.026 . . . . 0.0 111.664 179.357 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.3 m . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.718 0.294 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -60.21 -36.08 76.87 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.429 ' OE2' ' HD3' ' A' ' 8' ' ' LYS . 15.0 tp10 -64.0 -28.38 69.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.971 0.415 . . . . 0.0 111.001 -176.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.5 tp10 -71.82 -35.83 70.06 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.1 0.476 . . . . 0.0 110.521 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -88.5 -45.72 9.7 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.26 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.87 -57.57 3.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.603 -177.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.8 m 62.34 98.29 0.03 OUTLIER 'General case' 0 C--O 1.234 0.28 0 O-C-N 123.838 0.711 . . . . 0.0 110.83 -175.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.429 ' HD3' ' OE2' ' A' ' 3' ' ' GLU . 0.5 OUTLIER -66.12 145.46 99.0 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.916 -179.782 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -64.75 152.63 81.32 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.901 2.4 . . . . 0.0 112.066 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.3 mmt -85.86 130.51 34.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.519 -178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 39.9 p -77.8 178.2 7.57 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 175.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -59.29 -49.59 77.27 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 120.951 -0.299 . . . . 0.0 110.728 -174.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -52.13 -49.63 63.33 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.589 0.709 . . . . 0.0 109.711 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -61.41 -44.93 96.29 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.46 -1.246 . . . . 0.0 110.842 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -60.38 -41.81 94.57 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.402 177.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -64.73 -41.54 95.88 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.826 0.346 . . . . 0.0 110.396 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -57.49 -47.56 81.58 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.556 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -61.91 -41.06 97.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.731 178.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 83.9 p -63.81 -25.32 68.12 Favored 'General case' 0 C--N 1.319 -0.724 0 O-C-N 121.211 -0.93 . . . . 0.0 110.449 176.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 89.9 mt -84.73 -42.99 14.71 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.448 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.603 ' OD1' HG21 ' A' ' 71' ' ' VAL . 1.1 p30 -67.4 -41.36 85.06 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 121.258 -0.177 . . . . 0.0 110.785 177.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -58.43 -40.57 78.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.015 0.436 . . . . 0.0 110.269 175.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -68.34 -30.92 69.99 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.143 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 39.9 mttp -62.07 -35.37 78.45 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.978 0.418 . . . . 0.0 111.346 173.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.625 HD11 HG12 ' A' ' 71' ' ' VAL . 95.0 mt -68.35 135.79 91.06 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.549 -0.751 . . . . 0.0 112.313 -172.011 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.2 Cg_endo -80.83 172.09 13.59 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.342 2.695 . . . . 0.0 112.803 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.52 -43.46 52.69 Favored Glycine 0 C--O 1.237 0.332 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.378 -175.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 5.5 mp0 -48.62 -55.87 10.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.522 0.677 . . . . 0.0 111.148 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.584 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -80.37 -27.06 38.3 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.445 -174.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 34' ' ' VAL . 11.0 mt -62.64 -27.75 69.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.598 -0.274 . . . . 0.0 110.626 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.49 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.574 174.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 36' ' ' ILE . 12.6 tpp180 -66.24 -41.52 89.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.671 0.272 . . . . 0.0 110.675 176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 67' ' ' LEU . 93.7 t -56.85 -52.14 58.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.88 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 30' ' ' LEU . 22.2 t -64.17 -36.84 78.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.455 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -59.45 -41.63 90.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.206 177.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.1 mt -66.73 -48.69 79.27 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.24 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 33' ' ' VAL . 55.0 mt -58.88 -55.83 20.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.036 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 37.2 mt-30 -62.3 -34.1 75.94 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -175.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 26.3 t -78.28 -36.13 47.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -176.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.62 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 5.9 mpt_? -80.32 -27.88 38.29 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.424 177.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.635 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 60.0 mm-40 -114.21 87.05 12.66 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.851 178.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -64.12 -13.1 35.79 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.125 1.883 . . . . 0.0 112.109 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.9 t -72.7 -20.95 61.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.232 0.539 . . . . 0.0 109.803 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.1 mt -104.1 33.82 3.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.228 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -72.74 -17.65 61.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.505 -179.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -98.71 41.86 1.12 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.778 0.799 . . . . 0.0 110.062 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.9 m -88.51 91.01 8.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.424 177.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 87.2 m-20 -60.04 123.22 71.38 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.19 177.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 59.4 Cg_exo -56.24 -19.04 26.09 Favored 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 123.253 2.635 . . . . 0.0 113.147 -179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -80.19 -27.82 38.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.025 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -146.85 78.67 1.5 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.921 -176.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 23.2 mt -92.25 125.74 44.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.205 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -104.55 119.63 39.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.651 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.446 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 48.2 mt -96.87 109.42 23.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.238 175.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 17.0 p-10 -109.39 98.62 7.99 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.931 0.872 . . . . 0.0 110.078 175.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -68.89 -0.35 5.42 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.802 -175.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 22.9 mm-40 -85.6 -24.69 27.06 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.95 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 47.2 p -101.78 -26.01 13.62 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.529 HD23 ' HG3' ' A' ' 41' ' ' GLU . 31.3 mt -53.8 128.78 31.2 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.647 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.635 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 23.1 mttm -71.91 150.99 92.97 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.657 178.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -47.11 -36.5 21.43 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.296 1.997 . . . . 0.0 112.426 174.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 25.6 t -54.4 -54.43 40.73 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.0 -49.62 76.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.668 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 78.7 mt -57.38 -37.64 72.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.306 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -77.6 -45.97 23.55 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.085 -179.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.7 mt-10 -63.92 -36.66 84.67 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-O 120.789 0.328 . . . . 0.0 110.457 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.538 HD22 HG13 ' A' ' 33' ' ' VAL . 83.6 mt -62.2 -56.1 22.06 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.116 174.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.16 -46.83 75.76 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.144 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 -63.03 -31.93 73.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.795 -177.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -78.53 -47.78 16.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.612 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.625 HG12 HD11 ' A' ' 25' ' ' LEU . 15.7 m -63.12 -42.47 96.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.14 0.495 . . . . 0.0 110.471 -176.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.404 ' N ' HG23 ' A' ' 71' ' ' VAL . 24.7 p -63.91 -36.66 84.67 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.933 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 82.9 p -67.73 -24.23 65.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.584 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.3 t -91.14 -32.35 15.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.433 -177.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.601 HD21 HD23 ' A' ' 25' ' ' LEU . 28.1 mt -97.79 -43.05 7.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.404 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 20.9 mtp180 -71.46 -10.7 60.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.096 0.474 . . . . 0.0 110.377 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -106.76 -28.14 10.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.283 176.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -151.53 75.38 1.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.84 -176.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.497 ' HD2' ' H ' ' A' ' 79' ' ' ARG . 0.1 OUTLIER -60.99 130.03 44.39 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.784 0.326 . . . . 0.0 110.158 176.016 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 51.9 tptt 58.15 74.89 0.58 Allowed Pre-proline 0 C--O 1.236 0.363 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.355 -172.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.41 97.48 1.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 123.084 2.523 . . . . 0.0 112.037 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -83.34 -30.83 27.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.412 0.625 . . . . 0.0 109.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.13 179.654 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 110.243 -0.281 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 96.2 mt -82.65 -18.17 42.03 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.057 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -83.89 29.37 0.55 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.674 -177.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 32.4 p -172.07 156.26 3.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.847 0.356 . . . . 0.0 111.113 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 35.2 m -100.02 99.55 10.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.789 174.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.415 HD12 ' N ' ' B' ' 204' ' ' ILE . 4.0 mp -74.21 124.46 31.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.446 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 26.9 t -104.9 105.31 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.337 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.2 ttmm -96.01 118.02 31.81 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 169.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.456 ' CZ ' HD22 ' A' ' 30' ' ' LEU . 10.3 p90 -131.75 137.32 48.15 Favored 'General case' 0 C--N 1.317 -0.812 0 C-N-CA 120.079 -0.648 . . . . 0.0 110.67 177.34 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 59.0 mttm -85.7 111.4 20.08 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -73.11 121.32 84.81 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.293 -176.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.92 143.82 86.46 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.494 2.129 . . . . 0.0 111.151 175.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.4 ' N ' ' HD3' ' B' ' 212' ' ' PRO . 87.4 mt 60.7 65.37 2.11 Favored Pre-proline 0 C--N 1.329 -0.321 0 O-C-N 123.664 0.602 . . . . 0.0 111.351 -178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . 0.4 ' HD3' ' N ' ' B' ' 211' ' ' LEU . 24.7 Cg_exo -63.79 -38.45 39.38 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.268 1.978 . . . . 0.0 111.301 176.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.31 71.14 4.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 174.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 5.8 t -69.52 121.39 16.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.489 0.661 . . . . 0.0 111.392 -175.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.439 ' HA ' ' HD3' ' B' ' 216' ' ' PRO . 12.5 pt20 -87.55 143.12 33.52 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.943 177.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' B' ' 215' ' ' GLN . 12.1 Cg_exo -70.67 77.22 1.42 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.976 2.451 . . . . 0.0 112.774 -178.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 119.005 -0.886 . . . . 0.0 111.406 177.293 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.672 ' O ' ' HG2' ' A' ' 4' ' ' GLU . 22.8 t . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -59.58 -35.59 74.57 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 -172.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -60.16 -36.34 77.35 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.703 0.229 . . . . 0.0 111.585 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.672 ' HG2' ' O ' ' A' ' 1' ' ' SER . 11.1 pt-20 -70.96 -27.45 63.75 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.915 0.388 . . . . 0.0 110.529 -179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -86.12 -28.21 24.16 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.402 0.62 . . . . 0.0 110.385 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -70.05 -40.87 74.84 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.451 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 m -84.05 99.35 10.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.382 -179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -75.94 145.19 77.25 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.584 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -63.9 124.34 13.41 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.494 2.129 . . . . 0.0 110.962 176.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.495 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.2 mmt -57.6 128.7 38.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.788 -177.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.7 p -73.07 175.61 6.55 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.892 177.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.311 -174.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.1 mm-40 -56.3 -40.18 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.158 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.11 -46.4 81.16 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.719 178.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.0 mttt -60.98 -39.56 90.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.394 177.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -64.2 -44.74 91.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 176.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.38 -44.24 88.82 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.829 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.93 -39.89 79.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.819 -176.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.49 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 87.5 p -63.48 -25.77 68.41 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.715 -0.615 . . . . 0.0 110.328 175.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.2 mt -82.69 -44.76 15.3 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.164 179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.829 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.6 p30 -62.09 -41.19 97.94 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.409 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.437 ' HA ' HD12 ' A' ' 25' ' ' LEU . 84.6 mt -62.94 -40.11 87.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.907 178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -68.42 -28.5 67.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.962 0.411 . . . . 0.0 111.213 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.5 mtpp -78.25 -16.88 57.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 21' ' ' ASP . 84.5 mt -79.3 132.56 62.35 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.619 -176.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.561 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 78.3 Cg_endo -76.69 172.18 16.68 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 123.199 2.599 . . . . 0.0 113.085 -178.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.03 -45.54 50.98 Favored Glycine 0 C--N 1.334 0.442 0 O-C-N 123.301 0.376 . . . . 0.0 113.927 -172.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -49.79 -55.31 14.57 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.415 0.626 . . . . 0.0 110.993 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.9 mptp? -76.5 -31.43 57.71 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.944 -174.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 mt -58.39 -31.05 67.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.489 175.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.25 -34.53 89.48 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.847 -0.615 . . . . 0.0 112.268 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -79.03 -39.91 32.79 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.584 0.23 . . . . 0.0 110.499 178.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.542 HG13 HD22 ' A' ' 67' ' ' LEU . 93.3 t -56.18 -55.09 20.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.685 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.544 HG21 HD13 ' A' ' 52' ' ' ILE . 12.0 p -63.63 -30.77 50.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.638 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -65.26 -41.77 93.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.908 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.8 mt -65.99 -41.22 89.32 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.903 177.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.527 HG23 HD21 ' A' ' 59' ' ' LEU . 72.8 mt -62.41 -60.56 2.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.218 178.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -65.83 -29.67 70.17 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -173.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -78.28 -38.79 41.79 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.05 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.462 ' O ' ' HE2' ' A' ' 60' ' ' LYS . 9.6 mpt_? -76.4 -31.92 58.23 Favored 'General case' 0 CA--C 1.514 -0.411 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.577 177.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.633 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 49.4 mm-40 -112.72 85.26 7.35 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.441 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.76 -12.26 30.71 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.363 2.042 . . . . 0.0 112.567 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -82.29 -5.27 58.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.071 0.462 . . . . 0.0 110.574 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.5 mt -115.63 27.42 9.33 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.02 177.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -80.3 -17.14 52.96 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.252 0.549 . . . . 0.0 110.476 -174.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -92.85 20.66 6.34 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.807 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 66.8 m -68.78 105.26 2.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.177 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.644 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -50.6 120.86 13.57 Favored Pre-proline 0 N--CA 1.463 0.187 0 O-C-N 123.118 0.262 . . . . 0.0 110.534 171.576 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.7 Cg_exo -59.08 -23.08 67.25 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.787 2.325 . . . . 0.0 111.556 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 21.9 m-20 -71.77 -35.96 70.21 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.643 178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB2' ' OD1' ' A' ' 48' ' ' ASN . 20.5 mm-40 -138.64 72.1 1.4 Allowed 'General case' 0 C--O 1.234 0.254 0 CA-C-N 118.035 0.379 . . . . 0.0 111.041 -178.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.544 HD13 HG21 ' A' ' 34' ' ' VAL . 28.9 mt -82.79 120.7 34.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.009 0.433 . . . . 0.0 111.136 -178.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.496 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 19.0 mm-40 -100.84 122.69 43.87 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.053 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.5 mt -91.04 108.76 20.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.466 -0.494 . . . . 0.0 109.952 175.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -107.19 98.85 8.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.163 0.982 . . . . 0.0 110.309 177.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.4 ' HD1' ' CD2' ' A' ' 64' ' ' LEU . 93.5 m-85 -70.67 -1.04 10.03 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.137 -174.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -84.35 -29.28 26.41 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.932 0.396 . . . . 0.0 110.765 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.6 p -90.7 -32.21 16.27 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' A' ' 41' ' ' GLU . 33.3 mt -53.18 126.98 22.73 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.118 178.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.633 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 27.5 mttm -66.03 147.58 98.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 176.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -49.5 -30.44 21.19 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.362 2.042 . . . . 0.0 111.762 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.482 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 13.6 m -60.51 -52.23 66.08 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 174.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -61.13 -46.46 90.47 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.461 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.4 ' CD2' ' HD1' ' A' ' 56' ' ' PHE . 78.6 mt -58.87 -39.18 80.62 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.843 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -68.23 -48.24 65.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.075 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 62' ' ' SER . 17.3 mm-40 -66.48 -40.72 89.46 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.853 -178.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.542 HD22 HG13 ' A' ' 33' ' ' VAL . 75.6 mt -57.15 -55.39 35.38 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.044 -0.526 . . . . 0.0 109.682 174.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -54.08 -42.4 69.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.91 178.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -59.86 -43.03 94.92 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.326 0.584 . . . . 0.0 110.167 -178.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -74.88 -46.55 35.37 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.969 -175.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.572 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.2 m -63.9 -38.1 81.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.074 0.464 . . . . 0.0 110.727 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.7 p -72.8 -38.44 67.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.056 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.2 p -64.84 -19.57 65.94 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.702 178.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 31.4 t -90.84 -54.83 3.8 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.65 177.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.2 mt -78.85 -27.46 44.16 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -171.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 57.1 mtp180 -87.06 -11.53 49.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.118 0.485 . . . . 0.0 110.621 179.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -94.83 -42.44 8.7 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -134.96 90.65 2.66 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.079 179.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -65.86 120.86 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 174.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt 65.07 82.41 0.21 Allowed Pre-proline 0 C--O 1.235 0.339 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 -170.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.41 59.86 2.57 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.402 2.735 . . . . 0.0 113.04 -176.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -80.26 104.04 10.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.19 0.519 . . . . 0.0 109.944 174.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.918 0 CA-C-O 118.414 -0.803 . . . . 0.0 109.868 178.872 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.74 0.305 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 64.5 mt -75.7 81.15 2.67 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.103 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -142.49 158.08 44.07 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.776 -177.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 27.3 m -141.72 -163.67 1.62 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 19.1 m -111.84 118.17 34.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.661 0.267 . . . . 0.0 110.802 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 10.6 pt -85.16 154.61 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.619 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.49 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 61.3 t -121.12 113.82 41.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.633 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.496 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 19.5 ttmm -92.67 116.65 29.21 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -129.57 143.31 50.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.245 0.545 . . . . 0.0 110.55 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 44.1 mttp -94.61 114.75 26.75 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.355 176.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . 0.407 ' HD2' HG11 ' A' ' 34' ' ' VAL . 81.9 tttt -79.17 112.59 29.26 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-O 120.808 0.337 . . . . 0.0 110.216 -177.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -78.59 58.02 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.901 2.4 . . . . 0.0 112.444 -176.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.407 ' HG ' HD22 ' B' ' 213' ' ' LEU . 24.9 tp -154.89 87.32 3.36 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.887 178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.52 -7.21 8.8 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.618 2.212 . . . . 0.0 113.149 -179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . 0.407 HD22 ' HG ' ' B' ' 211' ' ' LEU . 2.9 mm? 57.57 48.69 13.85 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.437 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.9 t -148.26 150.63 34.03 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.318 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.484 ' H ' ' HD2' ' B' ' 216' ' ' PRO . 50.5 tt0 -169.77 -52.08 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.887 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . 0.484 ' HD2' ' H ' ' B' ' 215' ' ' GLN . 96.3 Cg_endo -79.41 165.33 23.28 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.714 1.609 . . . . 0.0 112.418 178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.247 -1.307 . . . . 0.0 111.47 178.183 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.9 m . . . . . 0 N--CA 1.479 0.989 0 CA-C-O 120.735 0.302 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -98.31 -42.96 7.14 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -65.14 -24.64 67.46 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -173.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.56 -21.72 66.5 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.088 177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -86.47 -34.02 20.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.122 0.487 . . . . 0.0 110.467 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.5 tptp -77.97 -45.06 24.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.472 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.7 m 63.86 102.23 0.03 OUTLIER 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.628 0.58 . . . . 0.0 112.316 175.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -67.56 144.41 97.69 Favored Pre-proline 0 C--O 1.234 0.276 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 170.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.9 129.57 21.12 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.78 2.32 . . . . 0.0 110.993 177.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.541 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -64.67 128.14 34.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.567 -177.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.4 p -73.53 174.45 8.23 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -59.7 -46.7 88.28 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.475 -175.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 59.5 mm-40 -55.84 -44.23 77.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.368 . . . . 0.0 111.042 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -63.32 -46.09 88.29 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.913 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.541 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.6 mttt -61.25 -39.26 89.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.497 177.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 26.8 ttp180 -62.91 -43.62 98.29 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -56.75 -46.13 81.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.167 178.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.565 HD23 ' OD1' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -65.65 -33.17 75.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.424 -0.807 . . . . 0.0 111.464 -175.116 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.4 p -70.1 -27.16 64.37 Favored 'General case' 0 C--N 1.317 -0.824 0 O-C-N 121.51 -0.744 . . . . 0.0 109.986 175.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.544 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 85.8 mt -80.91 -46.01 15.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.201 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.587 ' CG ' HG21 ' A' ' 71' ' ' VAL . 1.3 p30 -65.44 -42.27 92.57 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 121.21 -0.196 . . . . 0.0 111.302 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.415 ' HA ' HD12 ' A' ' 25' ' ' LEU . 35.1 mt -60.37 -41.5 87.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-O 121.016 0.436 . . . . 0.0 110.493 176.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -65.14 -24.12 67.32 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.585 -177.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 28.6 mtpp -85.89 -7.63 58.57 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.938 0.399 . . . . 0.0 110.781 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.476 HD11 HG12 ' A' ' 71' ' ' VAL . 80.4 mt -86.23 137.67 34.78 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.571 -177.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -80.32 167.31 19.56 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.259 2.639 . . . . 0.0 112.841 177.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.01 -46.1 41.72 Favored Glycine 0 CA--C 1.521 0.454 0 N-CA-C 114.39 0.516 . . . . 0.0 114.39 -173.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 56.9 tt0 -53.67 -51.28 63.69 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.451 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.755 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -73.19 -32.73 64.99 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.642 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.553 HD21 ' CD1' ' B' ' 207' ' ' PHE . 10.6 tp -62.59 -24.63 67.66 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.65 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.87 99.51 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.909 -0.662 . . . . 0.0 111.493 174.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.1 tpm_? -67.85 -40.99 83.6 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.217 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.533 HG13 HD22 ' A' ' 67' ' ' LEU . 61.2 t -59.0 -58.15 8.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.008 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.13 -27.65 42.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.796 -176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -68.29 -41.96 80.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.301 -0.409 . . . . 0.0 109.964 176.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.58 HG13 ' HE ' ' A' ' 32' ' ' ARG . 61.8 mt -62.11 -43.47 97.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 CA-C-O 120.974 0.416 . . . . 0.0 110.31 177.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.487 HG12 HD11 ' A' ' 67' ' ' LEU . 53.2 mt -65.02 -58.5 6.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.402 -178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 25.0 mt-30 -63.07 -28.47 70.11 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -173.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -89.95 -27.74 19.61 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.489 -0.484 . . . . 0.0 112.123 -177.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 40' ' ' ARG . 5.0 mpt_? -81.89 -22.94 36.59 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.355 171.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -125.0 65.12 46.39 Favored Pre-proline 0 N--CA 1.442 -0.867 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.936 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -52.47 -17.93 7.4 Favored 'Trans proline' 0 N--CA 1.478 0.601 0 C-N-CA 122.971 2.447 . . . . 0.0 113.284 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.4 m -66.3 -21.85 66.27 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.963 175.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.4 mt -95.59 41.95 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.036 0.446 . . . . 0.0 110.306 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -73.56 -15.55 61.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.154 -174.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -96.52 35.1 1.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.875 0.369 . . . . 0.0 111.213 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 50.2 m -81.33 89.38 6.08 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.859 -0.422 . . . . 0.0 109.859 175.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.441 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 86.3 m-20 -61.35 123.44 76.23 Favored Pre-proline 0 CA--C 1.52 -0.209 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.126 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 71.1 Cg_exo -53.17 -21.74 17.68 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.654 2.903 . . . . 0.0 114.268 -174.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 4.6 p-10 -76.11 -36.3 58.92 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.875 -177.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -143.7 77.5 1.56 Allowed 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.449 HD12 ' CE1' ' B' ' 207' ' ' PHE . 26.2 mt -85.84 128.42 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.214 -177.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -101.15 117.87 35.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.523 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 52.8 mt -90.38 108.66 19.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 170.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.552 ' HA ' HD12 ' B' ' 204' ' ' ILE . 12.2 t70 -105.11 99.15 8.77 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -68.18 -13.37 62.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.494 -0.776 . . . . 0.0 112.547 -172.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -79.38 -35.26 41.06 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.789 0.328 . . . . 0.0 110.559 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.4 p -80.91 -21.89 40.18 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.994 176.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 25.0 mt -67.16 135.62 53.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.494 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 53.1 mttp -76.54 147.45 78.64 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.005 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -42.94 -40.46 8.45 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.929 2.42 . . . . 0.0 113.05 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.3 m -58.13 -50.22 74.25 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.036 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.4 -47.91 83.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.263 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.82 -37.56 71.37 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.023 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -70.63 -52.11 23.55 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.174 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -62.99 -39.34 94.44 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.619 0.247 . . . . 0.0 111.059 -177.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.533 HD22 HG13 ' A' ' 33' ' ' VAL . 85.9 mt -60.24 -57.97 10.54 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.682 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.513 ' HA ' HG22 ' A' ' 71' ' ' VAL . 7.9 tt0 -58.77 -45.79 88.99 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.726 0.298 . . . . 0.0 111.155 -178.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -57.67 -30.15 65.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.259 0.552 . . . . 0.0 110.295 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.428 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 65.1 t80 -82.88 -49.2 9.91 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.919 -179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.587 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.0 m -60.81 -36.18 69.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.239 0.543 . . . . 0.0 110.482 -176.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.494 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 22.3 p -69.95 -39.91 75.77 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.435 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 92.4 p -65.63 -20.07 66.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.795 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.755 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.5 t -90.76 -53.49 4.38 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 120.915 -0.314 . . . . 0.0 110.762 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.47 HD21 HD23 ' A' ' 25' ' ' LEU . 71.1 mt -77.28 -36.0 54.66 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -172.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 72' ' ' THR . 98.3 mtt180 -75.33 -7.62 54.46 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.249 0.547 . . . . 0.0 110.472 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -105.85 -47.1 3.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.166 176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -134.28 87.52 2.37 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.518 -173.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -75.1 133.94 41.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 172.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm 59.53 71.71 0.88 Allowed Pre-proline 0 N--CA 1.464 0.264 0 O-C-N 123.617 0.573 . . . . 0.0 110.174 -171.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -75.39 41.45 0.78 Allowed 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.234 2.623 . . . . 0.0 113.033 -177.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -71.92 -33.57 68.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.192 0.52 . . . . 0.0 110.141 178.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.597 -0.716 . . . . 0.0 109.692 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 54.2 t30 . . . . . 0 N--CA 1.48 1.054 0 CA-C-O 120.802 0.334 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 30.1 tp -88.48 -33.73 17.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.963 0.411 . . . . 0.0 110.116 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 67.4 mm-40 -65.15 119.35 10.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.522 176.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 21.4 m -101.23 172.85 6.75 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.027 -175.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 29.4 t -83.94 89.03 7.16 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.976 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.552 HD12 ' HA ' ' A' ' 55' ' ' ASP . 39.3 mm -85.74 121.55 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.093 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.442 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 58.2 t -85.27 117.73 30.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.328 -174.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -105.63 77.95 1.31 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.605 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.553 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.0 p90 -92.01 158.16 16.39 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.217 0.532 . . . . 0.0 110.478 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.494 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 12.4 mptt -106.73 135.26 48.58 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.624 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -121.03 81.24 35.43 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.244 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.95 -15.66 20.76 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.533 2.155 . . . . 0.0 111.914 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 94.1 mt -121.93 101.68 41.85 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.475 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -78.82 56.47 5.99 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.487 2.125 . . . . 0.0 112.658 -178.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . 0.507 ' H ' HD23 ' B' ' 213' ' ' LEU . 2.4 pt? -98.24 169.41 9.6 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 3.8 p -147.0 171.78 14.73 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.854 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' B' ' 215' ' ' GLN . 3.9 pt20 -147.03 111.27 4.08 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 121.232 0.539 . . . . 0.0 110.647 177.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -89.15 45.28 0.83 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.176 2.584 . . . . 0.0 111.926 177.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.454 -1.192 . . . . 0.0 111.649 -178.06 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 120.796 0.332 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -98.84 -4.99 31.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.674 0.274 . . . . 0.0 111.466 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -63.39 -43.02 98.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.166 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -59.15 -27.23 65.44 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.432 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -83.74 -29.42 27.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.222 0.534 . . . . 0.0 110.441 -179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -76.31 -28.63 57.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.808 178.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 59.7 m -90.86 99.09 12.19 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.392 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -75.75 144.78 77.24 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.34 178.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.51 135.93 51.97 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.847 2.365 . . . . 0.0 111.534 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -72.66 131.29 42.22 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.826 -175.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.8 p -76.06 176.71 7.71 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.782 176.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -60.33 -47.88 84.12 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.597 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -53.09 -47.61 68.42 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.399 0.618 . . . . 0.0 110.024 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -63.86 -45.03 91.29 Favored 'General case' 0 N--CA 1.434 -1.242 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.963 -174.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 96.2 mttt -59.2 -44.6 92.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.396 175.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.475 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 50.0 ttp85 -59.48 -47.62 84.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.163 176.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -58.85 -51.94 67.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.968 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -53.68 -49.82 67.16 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.827 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.427 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 93.5 p -62.57 -30.81 71.59 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.918 0.389 . . . . 0.0 111.076 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 94.0 mt -73.55 -41.98 62.26 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.798 179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 25' ' ' LEU . 23.0 m-20 -67.26 -41.51 85.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.291 179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.439 ' HA ' HD12 ' A' ' 25' ' ' LEU . 95.6 mt -58.1 -41.83 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.154 0 CA-C-O 121.057 0.456 . . . . 0.0 110.657 178.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -66.65 -27.59 67.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.532 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -78.92 -24.82 43.81 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.061 0.458 . . . . 0.0 110.451 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 75' ' ' LEU . 93.1 mt -66.67 135.49 94.46 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.398 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.534 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.8 Cg_endo -80.49 170.08 16.31 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.951 2.434 . . . . 0.0 112.858 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.59 -44.0 46.35 Favored Glycine 0 CA--C 1.519 0.329 0 O-C-N 123.195 0.309 . . . . 0.0 113.327 -175.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.3 mp0 -45.43 -54.09 7.83 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.5 0.667 . . . . 0.0 111.203 178.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.665 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.4 mptp? -82.71 -29.42 29.84 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.91 -175.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.3 mt -61.74 -27.64 68.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.443 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.3 -28.85 71.6 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.139 174.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.464 ' O ' HG13 ' A' ' 36' ' ' ILE . 14.5 tpp180 -84.31 -43.04 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 122.585 -0.362 . . . . 0.0 110.335 175.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.52 ' O ' HG13 ' A' ' 37' ' ' ILE . 43.4 t -55.07 -54.16 26.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.898 0.38 . . . . 0.0 110.713 179.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.49 -29.86 48.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.526 -178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -66.01 -39.86 90.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.638 177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.5 mt -66.93 -49.97 69.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.949 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 33' ' ' VAL . 50.0 mt -56.95 -59.73 2.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.089 -178.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.0 mt-30 -62.48 -32.46 73.36 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -173.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.9 t -80.24 -32.57 38.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -176.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -82.58 -25.13 33.56 Favored 'General case' 0 CA--C 1.516 -0.359 0 O-C-N 121.92 -0.488 . . . . 0.0 110.21 175.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.8 mm-40 -117.58 82.08 15.31 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.523 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -63.11 -15.11 45.91 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.584 2.189 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.9 t -78.31 -24.26 46.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 109.761 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 mt -89.55 17.94 5.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.199 0.523 . . . . 0.0 110.22 179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.1 ttpm? -74.0 -10.73 59.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.476 0.655 . . . . 0.0 109.683 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -84.22 4.93 28.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.257 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.0 m -67.48 97.84 0.61 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.299 -178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 89.8 m-20 -60.34 122.81 69.93 Favored Pre-proline 0 N--CA 1.452 -0.354 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 79.0 Cg_exo -52.09 -26.03 24.6 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.664 2.909 . . . . 0.0 113.451 -174.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -71.01 -29.68 65.69 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.186 -177.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -143.65 76.07 1.5 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.944 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 22.7 mt -88.4 126.91 41.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.86 0.362 . . . . 0.0 111.192 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 35.3 mm-40 -108.1 132.55 53.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.775 179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 37.0 mt -104.02 108.84 25.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 174.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -110.87 97.27 6.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.923 0.868 . . . . 0.0 110.601 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -68.12 -9.27 45.21 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.937 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.432 ' HG3' HD21 ' B' ' 200' ' ' LEU . 36.6 mm-40 -79.95 -21.4 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.472 -177.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.5 p -99.02 -25.24 14.62 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.47 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 23.3 mt -57.9 130.42 46.45 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.388 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -74.32 148.18 85.89 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.93 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -48.1 -33.93 22.31 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.75 2.3 . . . . 0.0 112.398 175.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.6 m -57.82 -53.32 59.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.46 176.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 m -62.33 -48.45 79.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.739 179.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 80.9 mt -57.24 -36.68 71.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.112 -179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -69.44 -50.24 47.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.816 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -65.35 -38.94 91.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.548 ' O ' HG13 ' A' ' 71' ' ' VAL . 85.1 mt -61.22 -56.03 25.26 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.342 176.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -55.14 -49.77 70.96 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.802 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -55.68 -38.34 69.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.674 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -75.85 -50.08 16.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.726 -178.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.548 HG13 ' O ' ' A' ' 67' ' ' LEU . 10.8 m -62.82 -35.79 72.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 -175.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.511 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.7 p -74.61 -38.46 62.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.663 178.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 88.6 p -64.99 -19.43 65.99 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.559 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.665 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.4 t -91.02 -55.02 3.71 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.74 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 25' ' ' LEU . 75.1 mt -74.28 -34.5 63.57 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -174.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 72' ' ' THR . 28.2 mtp180 -80.07 8.77 6.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.276 0.56 . . . . 0.0 110.226 177.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -114.79 -49.89 2.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.384 -0.825 . . . . 0.0 108.856 171.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 16.0 tppt? -142.92 86.62 1.94 Allowed 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 114.746 -1.116 . . . . 0.0 109.201 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -72.08 -18.16 61.94 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.976 0.417 . . . . 0.0 111.312 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 54.2 tptt -129.5 87.58 52.64 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 174.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.71 -152.44 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 123.082 2.522 . . . . 0.0 112.09 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -68.55 -22.1 64.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.025 0.44 . . . . 0.0 110.757 178.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.461 ' HB3' ' HB3' ' A' ' 26' ' ' PRO . . . . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.538 -0.744 . . . . 0.0 110.336 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 N--CA 1.477 0.913 0 CA-C-O 120.667 0.27 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.432 HD21 ' HG3' ' A' ' 57' ' ' GLU . 2.4 pt? -151.9 150.62 30.26 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.773 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -96.59 68.97 2.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.089 0.471 . . . . 0.0 110.484 -177.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 4.6 m -64.0 -45.67 87.97 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.255 0.55 . . . . 0.0 109.528 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 31.8 t -173.37 -55.09 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.784 -1.098 . . . . 0.0 108.331 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.92 77.51 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.284 174.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.427 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 39.6 t -82.36 133.93 28.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.842 -175.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 18.7 ttmm -116.65 119.9 36.97 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -129.86 137.88 50.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.155 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -89.5 115.02 26.61 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.952 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' B' ' 209' ' ' LYS . 1.5 ttpm? -133.9 69.76 75.11 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.481 ' O ' ' HD3' ' B' ' 212' ' ' PRO . 37.9 Cg_exo -60.1 -24.09 75.62 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.081 2.521 . . . . 0.0 112.41 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.423 HD21 ' OG1' ' B' ' 214' ' ' THR . 58.3 tp -104.57 101.66 29.41 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.235 177.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . 0.481 ' HD3' ' O ' ' B' ' 210' ' ' PRO . 16.7 Cg_exo -68.55 -52.51 0.43 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.745 2.296 . . . . 0.0 111.106 175.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -160.74 142.57 12.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.946 175.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . 0.423 ' OG1' HD21 ' B' ' 211' ' ' LEU . 9.4 m -87.45 92.35 9.05 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -130.65 81.72 66.79 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.853 0.359 . . . . 0.0 111.12 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -79.02 -12.85 14.38 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.211 1.941 . . . . 0.0 110.793 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 119.039 -0.867 . . . . 0.0 110.977 178.903 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 120.753 0.311 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -66.06 -33.39 75.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.458 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -62.58 -35.97 81.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.919 0.39 . . . . 0.0 110.413 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.05 -44.97 52.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.137 -175.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -79.02 -34.85 43.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.62 0.247 . . . . 0.0 111.629 -175.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -88.5 -34.68 17.34 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.62 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.3 m 64.55 100.29 0.04 OUTLIER 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 174.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -72.36 144.32 86.64 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.046 173.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -66.36 124.23 12.22 Favored 'Trans proline' 0 C--O 1.236 0.383 0 C-N-CA 122.801 2.334 . . . . 0.0 111.667 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -58.75 125.76 24.82 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.904 -176.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.2 p -72.49 175.22 6.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 175.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.15 -49.24 78.63 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.874 0.306 . . . . 0.0 110.356 -175.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -55.12 -41.74 72.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.08 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.85 -46.02 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.938 179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.67 -42.89 89.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.416 176.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.8 ttp180 -63.95 -43.5 95.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.298 177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -58.85 -43.06 90.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.369 178.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -65.64 -38.4 89.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.275 -177.44 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 80.8 p -64.55 -28.13 69.43 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 119.979 -0.689 . . . . 0.0 110.093 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 84.2 mt -82.59 -41.21 19.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.459 -178.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.687 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -67.47 -40.87 85.32 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.682 177.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 79.7 mt -58.78 -40.07 78.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.093 0.473 . . . . 0.0 110.197 175.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -69.87 -29.4 66.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.824 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 47.2 mttp -64.13 -34.18 77.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.247 0.546 . . . . 0.0 110.966 173.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.671 HD11 HG12 ' A' ' 71' ' ' VAL . 95.4 mt -69.26 131.0 90.61 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.344 -0.843 . . . . 0.0 112.214 -172.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -77.54 172.9 15.04 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 123.525 2.817 . . . . 0.0 112.431 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.33 -45.94 52.38 Favored Glycine 0 CA--C 1.518 0.266 0 O-C-N 123.324 0.39 . . . . 0.0 113.846 -172.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.534 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 9.0 mp0 -47.26 -52.47 15.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.643 0.735 . . . . 0.0 111.034 -178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.577 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 2.1 mptp? -78.36 -23.8 46.72 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.155 -173.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.462 ' HA ' HD23 ' A' ' 30' ' ' LEU . 11.4 mt -62.11 -27.37 68.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.124 177.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.29 -35.99 92.41 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.727 -0.67 . . . . 0.0 112.067 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 36' ' ' ILE . 15.5 tpp180 -78.92 -40.83 31.08 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 121.199 -0.201 . . . . 0.0 110.698 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 37' ' ' ILE . 93.5 t -57.3 -53.62 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.002 179.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.1 p -64.59 -30.71 51.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.963 0.411 . . . . 0.0 110.357 -179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.5 t60 -65.89 -40.98 92.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.962 177.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 32' ' ' ARG . 64.8 mt -65.85 -50.89 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.712 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.975 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.8 mt -58.56 -58.59 6.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 -178.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -61.01 -32.53 72.12 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -175.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.7 t -79.62 -38.68 33.29 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -176.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.402 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 9.1 mpt_? -75.6 -27.83 58.67 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.074 176.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.45 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 32.6 mm-40 -115.78 84.16 12.53 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.122 -178.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -64.82 -12.83 36.08 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.363 2.042 . . . . 0.0 111.966 178.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.4 m -79.76 -8.62 59.36 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.375 177.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.6 mt -113.1 26.96 10.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.09 179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 47.3 tttp -69.69 -23.39 63.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.403 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.69 21.43 1.53 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.024 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.0 m -75.1 91.08 2.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.83 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -53.0 125.86 41.63 Favored Pre-proline 0 CA--C 1.52 -0.211 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.998 173.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.27 -15.18 17.74 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.836 2.357 . . . . 0.0 112.159 177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.514 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 16.7 m-20 -85.2 -29.79 24.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.555 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -139.6 59.68 1.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.697 -179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 18.9 mt -69.64 125.0 26.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.083 0.468 . . . . 0.0 111.508 -175.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -104.93 126.33 51.88 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.616 179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 60.2 mt -107.28 108.3 24.88 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 173.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.455 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 7.5 p-10 -110.53 103.6 12.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.83 0.824 . . . . 0.0 110.762 176.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -69.68 -12.28 61.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.556 -174.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -74.56 -27.68 60.61 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.458 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.1 p -95.54 -28.03 15.07 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.097 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 35.6 mt -56.62 127.1 29.7 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.666 177.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.0 mptt -71.46 146.95 92.27 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 176.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -43.5 -32.85 3.92 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.864 2.376 . . . . 0.0 113.004 173.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.46 -54.72 43.87 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 120.686 0.279 . . . . 0.0 110.645 176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.7 m -60.88 -47.73 85.03 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.234 178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.3 mt -55.74 -39.87 71.75 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.712 -0.677 . . . . 0.0 110.92 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.3 tpt180 -70.47 -49.25 50.51 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.244 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -63.8 -36.56 84.29 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.775 0.321 . . . . 0.0 110.632 -177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.551 ' O ' HG13 ' A' ' 71' ' ' VAL . 84.8 mt -60.82 -56.46 20.95 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.998 174.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -54.48 -43.03 71.4 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.99 178.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -60.16 -39.29 85.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.375 0.607 . . . . 0.0 110.35 -178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -75.85 -47.07 27.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.775 -176.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.671 HG12 HD11 ' A' ' 25' ' ' LEU . 11.7 m -64.08 -42.71 96.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.07 0.462 . . . . 0.0 110.641 -175.051 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 25.3 p -67.69 -32.29 72.85 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.491 -178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 18.7 t -66.15 -25.32 66.91 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.263 178.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.577 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.7 t -91.72 -45.37 8.47 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.977 0.418 . . . . 0.0 110.414 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.602 HD21 HD23 ' A' ' 25' ' ' LEU . 26.7 mt -85.51 -28.5 24.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -169.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 72' ' ' THR . 30.7 mtp180 -80.43 8.8 6.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.476 0.655 . . . . 0.0 110.116 177.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 52.9 tttp -120.65 -50.34 2.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.077 170.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' A' ' 75' ' ' LEU . 75.3 mmtt -132.63 109.74 9.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.197 177.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 79' ' ' ARG . 10.8 ptp180 -87.3 -11.91 48.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.517 0.199 . . . . 0.0 111.38 -176.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -136.78 68.77 58.87 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 120.852 0.358 . . . . 0.0 110.782 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -79.46 49.29 3.12 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 123.084 2.523 . . . . 0.0 111.982 -179.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -156.08 157.21 35.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.229 -178.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.84 -0.6 . . . . 0.0 109.953 178.187 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 9.3 p30 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 86.5 mt 51.87 46.91 25.8 Favored 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.55 0.531 . . . . 0.0 111.133 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -160.34 100.45 1.35 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.586 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 30.6 p -138.87 -63.33 0.53 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.925 174.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 9.0 t -172.76 132.02 0.55 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.279 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 58.3 mt -122.88 104.79 15.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.14 0.495 . . . . 0.0 110.097 175.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.499 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 47.3 t -92.91 108.03 19.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.62 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 4.4 ttmp? -104.28 109.8 21.77 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.135 177.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 12.4 p90 -126.84 151.1 48.8 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.044 -179.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.609 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 67.6 mttm -96.75 130.74 43.94 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.747 177.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 61.7 tttp -101.34 95.17 4.68 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.822 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.609 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 5.2 Cg_exo -77.84 71.22 6.67 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 123.19 2.593 . . . . 0.0 112.433 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 33.0 tp -68.87 116.61 43.06 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 176.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.06 45.37 1.79 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 122.927 2.418 . . . . 0.0 112.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 34.0 tp -122.86 44.91 2.52 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.331 0.586 . . . . 0.0 110.285 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 28.3 m -72.42 -36.92 68.73 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.331 0.586 . . . . 0.0 109.911 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -135.79 102.56 10.27 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.94 178.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -47.73 127.27 13.91 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.094 2.529 . . . . 0.0 112.439 -178.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.951 -0.916 . . . . 0.0 111.661 -177.673 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -86.79 -22.81 25.67 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.339 -177.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.29 -44.48 94.93 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.127 0.489 . . . . 0.0 110.138 -178.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -68.7 -21.15 64.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.344 179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -79.52 -36.43 38.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.32 0.581 . . . . 0.0 109.994 177.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -69.77 -51.02 37.61 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.119 177.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 87.6 m -79.36 100.48 7.63 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.202 -178.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -68.27 144.17 96.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -65.26 149.72 88.23 Favored 'Trans proline' 0 C--O 1.232 0.224 0 C-N-CA 122.843 2.362 . . . . 0.0 112.075 -177.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.5 mmt -85.95 119.89 26.75 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.9 p -67.6 174.64 3.35 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 177.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -57.95 -46.95 84.29 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.519 -0.472 . . . . 0.0 109.762 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -51.26 -48.7 62.11 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.682 0.753 . . . . 0.0 109.943 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -65.15 -46.06 82.47 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.062 -175.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.03 -38.98 73.94 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.268 176.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 16' ' ' ARG . 39.1 ttp180 -62.76 -44.37 96.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.327 175.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -59.74 -43.47 94.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.502 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.778 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.8 OUTLIER -66.42 -38.06 86.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.305 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.7 p -65.37 -26.8 68.17 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.628 -0.67 . . . . 0.0 110.359 176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.6 mt -80.86 -43.87 19.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.396 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.778 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -64.09 -43.8 94.26 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.862 -0.335 . . . . 0.0 110.775 178.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.9 mt -59.21 -41.96 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.931 0.396 . . . . 0.0 110.724 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -70.25 -27.44 64.44 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.117 -177.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -74.5 -33.97 62.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.491 177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.561 HD23 HD21 ' A' ' 75' ' ' LEU . 77.9 mt -56.94 138.19 79.13 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.333 -175.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.693 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 59.0 Cg_endo -79.22 163.24 25.22 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 123.521 2.814 . . . . 0.0 111.583 178.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.31 -27.15 60.13 Favored Glycine 0 CA--C 1.52 0.356 0 CA-C-N 115.151 -0.931 . . . . 0.0 114.855 -169.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.514 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.4 mp0 -63.07 -54.47 37.46 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 117.594 0.697 . . . . 0.0 109.711 178.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.693 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 3.8 mptt -72.22 -26.7 62.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.902 -176.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 12.4 mt -63.02 -25.7 68.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.014 176.185 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.26 -33.57 86.46 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.944 174.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.44 ' O ' HG13 ' A' ' 36' ' ' ILE . 9.0 tpp180 -79.96 -41.99 24.86 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 122.752 -0.264 . . . . 0.0 110.37 177.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.51 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -56.36 -52.72 48.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.472 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.83 -31.24 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.477 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 23.3 t60 -66.18 -42.14 89.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.998 176.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.1 mt -65.93 -51.4 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.51 HG13 ' O ' ' A' ' 33' ' ' VAL . 47.6 mt -57.72 -59.31 3.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.779 -178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.424 ' OE1' ' HA ' ' A' ' 45' ' ' LYS . 9.9 mt-30 -61.93 -33.74 74.81 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -175.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.5 t -76.56 -36.28 57.71 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.592 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -78.47 -31.24 47.79 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.075 0.464 . . . . 0.0 110.024 175.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.492 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 16.5 mm-40 -116.33 83.26 12.8 Favored Pre-proline 0 N--CA 1.443 -0.792 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.105 -177.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.89 -15.13 48.84 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.389 2.059 . . . . 0.0 112.456 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -74.52 -19.75 60.24 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.987 0.422 . . . . 0.0 110.199 177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 82.9 mt -95.5 19.01 11.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.424 ' HA ' ' OE1' ' A' ' 38' ' ' GLN . 55.1 tttm -69.98 -9.12 54.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.275 0.56 . . . . 0.0 110.598 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -87.14 11.0 15.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.916 -179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.5 m -72.81 91.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 46.9 m-80 -62.96 121.76 70.73 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 174.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 76.8 Cg_exo -46.99 -34.89 17.47 Favored 'Trans proline' 0 N--CA 1.477 0.526 0 C-N-CA 124.202 3.268 . . . . 0.0 114.977 -170.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -71.75 -22.44 61.61 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.636 0.255 . . . . 0.0 111.526 -178.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -140.55 70.65 1.36 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.05 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.4 mt -86.33 121.21 37.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.846 0.355 . . . . 0.0 110.772 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -104.51 126.55 51.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.615 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.411 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.8 mt -103.66 109.79 28.13 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-O 120.655 0.264 . . . . 0.0 110.551 176.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -107.15 99.13 8.7 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 122.157 0.98 . . . . 0.0 110.626 175.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -68.14 -4.32 13.37 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.739 -176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -80.01 -22.66 42.21 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.602 0.239 . . . . 0.0 110.823 -178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 66.6 p -101.17 -24.42 14.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.782 0.325 . . . . 0.0 110.153 176.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 37.4 mt -59.46 125.2 22.69 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.071 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.32 149.6 91.56 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.051 177.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -42.7 -36.43 4.94 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.722 2.281 . . . . 0.0 113.452 174.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 m -56.92 -55.02 39.92 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.411 0.148 . . . . 0.0 111.215 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.407 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.7 m -59.84 -46.11 90.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 0.0 110.208 178.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.96 -37.32 76.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.203 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -73.77 -44.81 54.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.026 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.5 -39.83 92.34 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.848 0.356 . . . . 0.0 110.435 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.539 ' O ' HG13 ' A' ' 71' ' ' VAL . 90.8 mt -60.67 -55.79 29.05 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.27 175.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -55.77 -45.9 78.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.341 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.06 -39.09 77.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.061 0.458 . . . . 0.0 111.165 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -77.44 -47.16 20.42 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.023 -0.535 . . . . 0.0 112.038 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.554 HG21 ' CG ' ' A' ' 21' ' ' ASP . 16.6 m -62.72 -36.56 75.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 121.078 0.466 . . . . 0.0 110.735 -175.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.0 p -72.22 -30.71 65.18 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.701 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.8 p -71.79 -19.97 61.93 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.862 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.492 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 47.6 t -90.95 -51.86 5.14 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.766 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.561 HD21 HD23 ' A' ' 25' ' ' LEU . 65.5 mt -79.21 -37.96 36.89 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -172.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 31.5 mtp180 -79.51 -5.53 55.04 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.75 -177.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -107.57 -30.91 8.34 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.931 176.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 40.0 mmtm -140.07 110.81 6.8 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.707 177.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -74.55 -25.22 59.17 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.192 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -136.87 110.47 9.34 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.689 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -47.72 126.26 12.38 Favored 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 123.394 2.729 . . . . 0.0 113.384 -178.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -106.85 164.08 12.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.244 177.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.149 0 CA-C-O 118.448 -0.787 . . . . 0.0 109.855 178.762 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.831 -0.063 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 37.0 tp 55.72 55.11 7.46 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.645 0.736 . . . . 0.0 110.056 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -130.78 85.16 2.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.454 -177.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 10.6 m -70.84 -48.05 56.06 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 173.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 15.8 t -177.48 91.95 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.085 -0.962 . . . . 0.0 108.954 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 68.6 mt -86.44 110.83 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.411 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 44.2 t -92.74 103.34 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.138 -175.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.7 ttmm -93.91 100.83 12.92 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 172.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.435 ' CE1' ' HB2' ' B' ' 209' ' ' LYS . 32.1 p90 -105.47 124.1 48.99 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.561 175.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -80.18 94.05 5.96 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.705 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . 0.435 ' HB2' ' CE1' ' B' ' 207' ' ' PHE . 56.9 tttm -87.34 129.72 50.36 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.289 -174.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -82.33 171.26 12.62 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.587 2.191 . . . . 0.0 111.566 173.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 95.1 mt -128.72 84.73 62.25 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.939 177.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -59.77 122.43 11.43 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.486 2.124 . . . . 0.0 111.308 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 91.1 mt -83.07 25.24 0.71 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.097 0.475 . . . . 0.0 111.315 -176.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.1 p -79.78 68.32 5.82 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.862 174.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 61.75 66.32 1.54 Allowed Pre-proline 0 C--O 1.234 0.237 0 CA-C-N 114.944 -1.025 . . . . 0.0 110.76 -174.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -74.18 130.31 14.05 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.584 2.189 . . . . 0.0 112.162 -178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.285 -1.286 . . . . 0.0 111.201 179.777 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.7 m . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.707 0.289 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -57.91 -40.07 79.45 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -65.36 -54.93 21.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.624 -175.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -75.19 -23.15 57.64 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.083 -175.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -66.7 -36.97 83.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.34 0.591 . . . . 0.0 109.786 173.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -71.21 -26.38 62.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.072 177.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 61.3 m -87.54 98.47 11.42 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.922 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -73.49 141.67 80.23 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 177.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -57.45 123.66 14.29 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 123.115 2.543 . . . . 0.0 112.016 -175.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.4 mmt -57.63 132.41 53.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.145 -178.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 36.0 p -77.75 174.77 10.61 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.47 -45.96 84.21 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 109.919 -178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -56.41 -44.86 80.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.816 -179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -64.69 -47.09 79.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.432 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -57.79 -40.4 79.81 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.277 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.5 ttp-105 -59.97 -45.43 92.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.238 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -61.78 -41.43 97.71 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.383 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.725 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.11 -41.16 82.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.925 -178.234 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.444 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 98.5 p -63.15 -25.16 68.22 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.526 -0.734 . . . . 0.0 110.592 175.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 77.9 mt -82.24 -45.28 15.23 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.633 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.725 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -61.78 -42.25 98.75 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.969 -0.292 . . . . 0.0 110.82 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.425 ' HA ' HD12 ' A' ' 25' ' ' LEU . 88.4 mt -59.65 -40.69 82.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.067 0.461 . . . . 0.0 110.656 177.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -71.33 -20.11 62.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.307 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.7 mtpp -85.15 -14.86 45.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.13 0.491 . . . . 0.0 110.437 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.547 HD11 HG12 ' A' ' 71' ' ' VAL . 92.7 mt -80.03 139.69 53.34 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.189 -178.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.556 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 98.6 Cg_endo -80.61 171.84 14.12 Favored 'Trans proline' 0 C--O 1.236 0.406 0 C-N-CA 123.206 2.604 . . . . 0.0 112.983 178.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.68 -38.68 64.54 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.622 -0.323 . . . . 0.0 113.33 -176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 11.1 mp0 -50.53 -56.39 11.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.603 0.716 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.613 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.3 mptp? -78.24 -27.91 47.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.005 -0.998 . . . . 0.0 110.595 -175.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -57.08 -31.06 64.85 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.745 175.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.39 -40.91 96.68 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.655 176.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.431 ' HG2' ' CE1' ' A' ' 70' ' ' TYR . 5.0 tpp180 -73.74 -40.99 63.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.428 0.156 . . . . 0.0 110.8 178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.507 HG13 HD22 ' A' ' 67' ' ' LEU . 60.7 t -56.58 -55.05 21.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.876 0.37 . . . . 0.0 110.65 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.432 HG21 HD13 ' A' ' 52' ' ' ILE . 7.1 p -65.71 -27.85 42.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.661 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 22.5 t60 -65.27 -43.64 90.62 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.844 176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.25 -42.77 97.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.145 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.1 mt -62.64 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.767 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -63.66 -32.43 73.91 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -173.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -72.58 -38.63 67.84 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.812 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.99 -30.8 56.1 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.93 0.395 . . . . 0.0 110.539 176.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 31.3 mm-40 -117.9 82.07 16.53 Favored Pre-proline 0 N--CA 1.445 -0.685 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.034 -177.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.5 -8.72 23.06 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.587 2.191 . . . . 0.0 112.838 -177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -87.48 -5.08 58.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.136 0.493 . . . . 0.0 110.439 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -105.11 25.56 10.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.148 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -76.72 -10.72 59.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.439 0.638 . . . . 0.0 109.684 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -78.99 0.5 27.36 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.767 178.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.2 m -69.78 99.37 1.35 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.253 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.4 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 1.5 p30 -57.06 124.35 65.09 Favored Pre-proline 0 CA--C 1.517 -0.295 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 173.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.6 Cg_exo -57.63 -11.69 9.64 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.935 2.424 . . . . 0.0 112.172 177.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -84.05 -36.07 23.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.634 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -136.44 65.31 1.52 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.775 0.322 . . . . 0.0 111.536 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.432 HD13 HG21 ' A' ' 34' ' ' VAL . 18.1 mt -76.49 124.52 34.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-O 121.117 0.484 . . . . 0.0 111.438 -175.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -108.82 110.73 22.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.837 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.406 HD12 ' HB ' ' B' ' 205' ' ' VAL . 53.8 mt -82.27 110.42 17.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 120.77 0.319 . . . . 0.0 110.383 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.663 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 12.0 t70 -103.95 99.0 8.76 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.449 179.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -71.97 -8.12 52.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.169 -176.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -84.22 -34.0 23.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.868 0.366 . . . . 0.0 110.792 -178.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 56.6 p -78.15 -31.89 49.99 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.839 175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.663 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 32.5 mt -58.91 128.48 37.44 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.904 -176.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 13.8 mtmm -72.36 150.97 91.93 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.871 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.15 -36.75 29.57 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.363 2.042 . . . . 0.0 112.518 176.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -59.26 -47.27 85.97 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.488 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.8 m -63.76 -47.67 80.07 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.173 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 71.6 mt -59.35 -35.26 73.54 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.086 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.9 tpt180 -72.1 -46.22 57.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.083 179.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -66.48 -39.71 88.91 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.962 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 89.7 mt -56.96 -57.06 14.18 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.699 174.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -56.06 -42.48 76.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.244 177.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 54.1 ttp85 -64.49 -33.45 75.92 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.162 0.506 . . . . 0.0 110.57 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.431 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 71.5 t80 -80.72 -47.17 14.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.782 -177.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.608 HG21 ' CG ' ' A' ' 21' ' ' ASP . 15.0 m -62.54 -37.97 80.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.104 0.478 . . . . 0.0 110.637 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.8 p -70.28 -36.7 74.55 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.849 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 32.8 t -62.66 -28.01 69.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.393 177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.613 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 44.4 t -89.55 -54.24 4.17 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.639 -0.425 . . . . 0.0 110.595 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.522 HD21 HD23 ' A' ' 25' ' ' LEU . 75.9 mt -76.1 -35.88 59.15 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -171.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 72' ' ' THR . 54.4 mtp180 -75.73 -5.43 45.66 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.043 -177.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 49.9 tttp -113.89 -39.42 3.98 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.741 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -145.31 86.37 1.76 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.125 -179.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -82.67 -5.08 58.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.236 0.541 . . . . 0.0 110.234 178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -109.2 92.98 12.12 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.792 175.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.409 ' HB3' ' HG3' ' A' ' 26' ' ' PRO . 88.8 Cg_exo -48.81 128.17 18.22 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 123.18 2.587 . . . . 0.0 113.177 -177.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -85.48 49.43 1.76 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.38 0.61 . . . . 0.0 110.533 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.889 179.039 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 120.966 0.412 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 25.4 tp -123.38 128.76 50.33 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -81.08 58.81 3.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.081 0.467 . . . . 0.0 110.851 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 45.9 t -65.37 -70.77 0.22 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.065 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 5.8 t -150.96 72.84 1.08 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 60.4 mt -77.68 97.31 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.922 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.444 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 66.6 t -77.73 134.45 28.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.467 -174.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -111.23 131.76 54.87 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.58 144.63 30.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.129 0.49 . . . . 0.0 110.538 173.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.47 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 56.8 mttm -97.37 120.54 37.92 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.398 179.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -100.2 103.88 25.87 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-O 120.665 0.269 . . . . 0.0 110.864 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 93.7 Cg_endo -86.14 84.86 1.08 Allowed 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.726 2.284 . . . . 0.0 111.749 179.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 42.0 tp -85.89 115.14 60.58 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.513 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -65.66 110.14 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.625 2.217 . . . . 0.0 111.885 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 96.7 mt -132.7 26.0 4.36 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.377 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . 0.442 ' O ' ' HD3' ' B' ' 216' ' ' PRO . 4.8 m 57.07 51.63 10.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.706 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -109.23 93.79 14.01 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.374 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' B' ' 214' ' ' THR . 90.2 Cg_endo -90.35 -173.61 0.67 Allowed 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.78 2.32 . . . . 0.0 112.028 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.183 0 CA-C-O 118.193 -1.337 . . . . 0.0 111.535 177.749 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.513 0.197 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -92.88 -24.93 18.3 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 122.243 -0.286 . . . . 0.0 111.689 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -59.83 -30.83 69.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 0.0 111.089 -174.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.39 -35.29 79.91 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.038 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -87.54 -40.88 13.89 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.4 0.619 . . . . 0.0 110.227 178.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -60.76 -38.16 84.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.506 -178.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.545 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 74.8 m -91.75 99.27 12.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.961 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -71.32 144.95 90.08 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 120.986 0.422 . . . . 0.0 110.637 176.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -61.41 124.83 15.47 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.687 2.258 . . . . 0.0 111.809 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.512 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -56.64 134.82 54.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.176 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.3 m -95.68 176.51 6.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 176.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -51.55 -54.5 26.79 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -166.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -48.93 -49.8 38.44 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-O 121.264 0.554 . . . . 0.0 110.691 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -61.94 -46.1 90.79 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.455 -174.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.512 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.8 mttt -58.01 -42.14 84.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.444 177.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 58.4 ttp180 -62.26 -44.76 95.8 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.334 177.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -63.93 -38.07 89.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.373 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.654 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.62 -39.19 80.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.756 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 91.6 p -64.26 -26.24 68.41 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.515 -0.74 . . . . 0.0 110.357 175.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 70.8 mt -81.68 -44.72 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.583 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.654 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.2 p30 -62.85 -41.7 99.47 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.676 178.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.446 ' HA ' HD12 ' A' ' 25' ' ' LEU . 94.2 mt -60.26 -41.0 85.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.003 0.43 . . . . 0.0 110.679 176.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -71.16 -24.18 62.2 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.245 -177.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 29.1 mtpp -80.31 -22.0 41.98 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.851 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.597 HD11 HG12 ' A' ' 71' ' ' VAL . 92.1 mt -70.27 139.0 86.94 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.489 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.592 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 74.4 Cg_endo -75.15 161.89 37.62 Favored 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.975 2.45 . . . . 0.0 111.463 175.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.93 -22.86 58.37 Favored Glycine 0 C--N 1.332 0.346 0 CA-C-N 115.337 -0.847 . . . . 0.0 114.003 -170.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -64.42 -52.08 59.96 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.338 0.589 . . . . 0.0 110.218 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 2.6 mptp? -69.31 -23.76 63.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.842 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.61 -27.52 69.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.65 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.86 -33.76 84.58 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.895 -0.669 . . . . 0.0 111.881 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.9 tpp180 -81.07 -40.84 23.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.447 0.165 . . . . 0.0 110.812 177.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.551 HG13 HD22 ' A' ' 67' ' ' LEU . 60.4 t -58.03 -52.05 63.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.918 0.39 . . . . 0.0 110.774 179.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.96 -30.16 49.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.649 -177.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -65.53 -41.99 92.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.756 177.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 32' ' ' ARG . 71.2 mt -64.79 -41.75 93.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.103 178.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 33' ' ' VAL . 60.9 mt -64.19 -61.5 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.353 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.538 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 28.5 mt-30 -63.17 -30.32 71.49 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -173.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 t -76.48 -36.79 57.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -80.3 -28.2 38.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.662 177.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 58.5 mm-40 -111.43 81.35 3.04 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.075 176.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -64.07 -15.07 47.2 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.395 2.063 . . . . 0.0 112.718 -177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -84.9 -3.79 58.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.146 0.498 . . . . 0.0 110.494 177.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 87.4 mt -107.59 23.72 14.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.79 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -64.4 -26.23 68.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.206 -177.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -95.61 41.51 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.342 -178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.538 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 68.7 m -80.24 107.16 12.81 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.455 ' OD1' ' HB2' ' A' ' 51' ' ' GLU . 2.9 p30 -55.84 122.78 48.73 Favored Pre-proline 0 C--O 1.228 -0.066 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.63 177.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -61.18 -9.03 11.39 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 123.127 2.551 . . . . 0.0 112.648 178.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.486 ' CG ' ' HG2' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -82.98 -44.36 15.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.928 179.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HG2' ' CG ' ' A' ' 50' ' ' ASP . 5.5 mm-40 -133.57 70.53 1.46 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.481 -177.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 13.4 mt -74.35 116.14 16.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 CA-C-O 121.319 0.58 . . . . 0.0 110.253 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.0 mm-40 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.59 -178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 47.7 mt -89.63 107.8 18.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.812 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 175.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -107.95 98.74 8.27 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.224 1.011 . . . . 0.0 110.76 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -66.78 -7.95 24.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.849 -176.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -78.94 -20.31 49.6 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -177.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.6 p -104.5 -29.58 10.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.445 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.463 HD23 ' HG3' ' A' ' 41' ' ' GLU . 36.2 mt -51.28 123.93 10.65 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.365 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 57.4 mttp -67.01 152.56 95.88 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.271 178.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.65 -40.81 30.93 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.444 2.096 . . . . 0.0 112.998 178.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.423 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 21.9 t -54.64 -50.96 66.87 Favored 'General case' 0 C--N 1.334 -0.107 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 177.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -51.05 71.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.43 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.415 HD21 ' HB2' ' A' ' 59' ' ' LEU . 77.0 mt -56.47 -39.74 73.71 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.168 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 22.7 tpt180 -72.51 -46.75 53.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.344 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 62' ' ' SER . 42.2 mt-10 -68.22 -39.37 82.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.754 0.311 . . . . 0.0 110.718 -176.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.553 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.9 mt -56.88 -55.25 36.88 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.593 173.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -56.04 -40.27 73.25 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.138 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.4 ttt180 -62.24 -43.71 98.21 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.441 0.639 . . . . 0.0 110.041 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.3 t80 -74.52 -43.89 53.76 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.716 -174.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.597 HG12 HD11 ' A' ' 25' ' ' LEU . 15.0 m -65.16 -37.63 80.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 120.993 0.425 . . . . 0.0 110.71 -177.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.405 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 36.7 p -74.43 -35.71 63.4 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.327 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 95.7 p -67.27 -19.93 65.57 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.428 177.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 18.1 t -91.28 -54.84 3.75 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.626 178.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.541 HD21 HD23 ' A' ' 25' ' ' LEU . 72.3 mt -78.26 -33.86 49.38 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -171.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.405 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 67.5 mtp180 -81.32 0.09 38.68 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.713 -177.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.1 tttm -114.12 -23.63 9.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.704 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 45.3 tptt -161.79 106.02 1.24 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.145 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -75.75 -16.01 60.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.96 0.41 . . . . 0.0 110.763 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -120.12 75.95 22.86 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 172.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.407 ' HB3' ' HE3' ' A' ' 29' ' ' LYS . 21.6 Cg_exo -64.72 115.53 3.28 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.948 2.432 . . . . 0.0 112.835 -172.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -95.16 -36.87 11.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.791 177.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.906 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.984 -179.678 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 8.3 p30 . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.929 0.395 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 9.7 mp -111.58 18.0 19.47 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.762 0.315 . . . . 0.0 111.193 -178.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -83.68 74.35 10.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.376 0.608 . . . . 0.0 110.808 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 20.2 m -104.01 -58.1 1.93 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 18.2 p -166.22 63.01 0.1 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.876 -179.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 40.6 mt -70.93 121.58 21.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.607 -177.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 40.8 t -96.89 109.69 23.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.483 -178.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 20.9 ttmm -95.8 111.05 23.11 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -127.67 144.35 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.613 176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -99.81 122.81 43.34 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.412 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 26.1 ttpt -113.28 99.82 50.07 Favored Pre-proline 0 C--N 1.322 -0.608 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.766 -176.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.405 ' O ' ' HD3' ' B' ' 212' ' ' PRO . 31.6 Cg_exo -59.26 138.85 87.17 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.273 1.982 . . . . 0.0 110.435 172.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 91.3 mt -75.38 115.48 45.75 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-O 120.739 0.304 . . . . 0.0 111.26 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . 0.405 ' HD3' ' O ' ' B' ' 210' ' ' PRO . 83.4 Cg_endo -87.33 152.6 7.95 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.885 2.39 . . . . 0.0 111.344 175.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 8.4 mp -79.66 126.99 31.64 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 11.0 p -77.86 93.45 4.37 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.793 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 57.8 tp60 61.21 79.48 0.28 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.583 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -79.65 53.74 4.87 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.051 179.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.366 -177.434 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.527 0.203 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.72 -31.98 72.3 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.532 -175.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.527 ' HG2' ' HB2' ' A' ' 62' ' ' SER . 6.9 tp10 -62.17 -37.19 84.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.023 0.44 . . . . 0.0 110.369 -179.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.15 -24.61 67.45 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.647 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -88.21 -23.73 23.48 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.001 -177.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -98.59 -49.22 4.7 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.726 -176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 63.8 m -103.8 100.86 10.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.443 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -72.08 147.01 90.64 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 177.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -62.77 123.7 12.78 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.874 2.383 . . . . 0.0 112.012 -176.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.531 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -55.37 136.02 49.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.625 -179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.7 m -91.75 175.21 6.98 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 178.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -51.76 -57.84 8.12 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -164.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -56.44 -34.12 66.53 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -177.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -68.36 -45.96 71.41 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.531 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.3 mttt -60.07 -42.12 93.87 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.846 176.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 16' ' ' ARG . 18.4 ttp85 -62.68 -43.5 98.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.483 178.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -67.23 -42.08 84.63 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.821 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.34 -50.03 74.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.264 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.422 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.1 p -59.77 -33.77 72.12 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.211 179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 78.2 mt -71.59 -42.22 68.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.757 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.546 ' HB3' HD12 ' A' ' 75' ' ' LEU . 67.7 m-20 -62.61 -44.31 96.61 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.548 0.214 . . . . 0.0 111.165 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.417 ' HA ' HD12 ' A' ' 25' ' ' LEU . 96.8 mt -61.22 -34.31 60.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.09 0.471 . . . . 0.0 111.35 178.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.98 -24.51 32.89 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 122.043 0.925 . . . . 0.0 108.747 -174.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.858 ' HD2' HD13 ' A' ' 75' ' ' LEU . 19.8 ttmt -73.06 -32.33 64.97 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.786 173.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.716 HD23 HD21 ' A' ' 75' ' ' LEU . 90.0 mt -62.6 142.12 96.77 Favored Pre-proline 0 N--CA 1.468 0.473 0 CA-C-O 121.153 0.502 . . . . 0.0 111.843 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.5 Cg_endo -82.38 169.56 13.94 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 123.045 2.497 . . . . 0.0 112.874 176.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.6 -46.0 53.83 Favored Glycine 0 CA--C 1.523 0.565 0 N-CA-C 114.482 0.553 . . . . 0.0 114.482 -172.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.424 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 3.2 mp0 -47.27 -56.83 6.02 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.823 0.82 . . . . 0.0 110.989 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.619 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -74.4 -24.88 59.18 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.666 -1.152 . . . . 0.0 110.814 -174.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 30' ' ' LEU . 13.9 mt -65.13 -27.41 68.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.266 177.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.24 -34.38 89.0 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.967 176.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.467 ' O ' HG13 ' A' ' 36' ' ' ILE . 19.4 tpp180 -77.7 -39.65 44.0 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 67' ' ' LEU . 87.0 t -57.64 -55.24 22.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.024 179.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.2 p -63.51 -30.48 49.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.898 0.38 . . . . 0.0 110.615 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -63.86 -42.12 97.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.749 176.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 32' ' ' ARG . 68.3 mt -66.0 -44.83 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.297 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -61.67 -60.55 2.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.165 -178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.36 -35.92 74.78 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -175.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.8 t -79.24 -33.85 43.26 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -174.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.98 -26.81 36.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.503 176.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' HD23 ' A' ' 59' ' ' LEU . 61.3 mm-40 -115.72 85.33 13.96 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.762 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -63.51 -13.2 34.91 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.23 1.954 . . . . 0.0 112.424 178.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.7 m -79.85 -10.04 59.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.001 0.429 . . . . 0.0 110.565 176.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 80.4 mt -108.81 29.01 7.86 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.119 0.485 . . . . 0.0 110.21 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.5 tptm -69.12 -23.75 64.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.335 -175.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -95.55 25.02 4.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.744 -0.207 . . . . 0.0 111.503 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.8 p -73.25 101.03 3.27 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.398 177.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 2.7 p30 -56.06 122.48 48.07 Favored Pre-proline 0 C--O 1.227 -0.131 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.452 178.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.3 Cg_exo -58.25 -14.37 19.56 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.936 2.424 . . . . 0.0 112.039 176.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.07 -37.44 29.0 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.699 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -136.92 59.97 1.67 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 120.645 0.259 . . . . 0.0 111.442 -175.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.611 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 19.7 mt -70.16 124.02 25.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.026 0.441 . . . . 0.0 111.496 -175.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' CD ' ' HB2' ' B' ' 206' ' ' LYS . 44.8 mm-40 -109.84 115.25 29.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.629 176.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 34.5 mt -90.11 109.97 21.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 177.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.478 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 16.0 p-10 -105.98 99.01 8.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.83 0.824 . . . . 0.0 110.659 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -69.94 -0.26 7.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.699 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.534 ' HG3' ' C ' ' B' ' 200' ' ' LEU . 5.0 mm-40 -87.88 -22.58 24.33 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.219 -175.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 75.4 p -102.18 -32.9 9.87 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.834 176.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.535 HD23 ' HG3' ' A' ' 41' ' ' GLU . 35.5 mt -48.3 123.03 5.9 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.025 177.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 56.2 mttp -65.26 152.04 92.68 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.792 178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -48.76 -35.04 29.43 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.435 2.09 . . . . 0.0 112.321 177.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.527 ' HB2' ' HG2' ' A' ' 3' ' ' GLU . 3.8 t -56.37 -53.04 62.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.855 176.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -61.99 -46.54 88.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.718 -178.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.406 HD21 ' HB2' ' A' ' 59' ' ' LEU . 81.9 mt -59.14 -36.18 74.78 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.061 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 31.0 tpt180 -76.83 -45.31 29.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.076 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.6 mm-40 -62.29 -45.51 92.92 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 110.527 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.618 ' O ' HG13 ' A' ' 71' ' ' VAL . 86.4 mt -57.37 -55.41 35.18 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.109 176.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -55.45 -47.99 75.19 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.055 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 71.8 ttt180 -58.17 -40.57 81.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.883 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -74.29 -47.57 33.98 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.641 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.618 HG13 ' O ' ' A' ' 67' ' ' LEU . 8.8 m -65.26 -35.34 75.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.81 0.338 . . . . 0.0 110.312 -175.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.498 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 35.6 p -72.88 -39.69 66.21 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.647 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 91.8 p -63.9 -21.77 66.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.729 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.619 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.2 t -90.77 -48.22 7.16 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 120.798 0.332 . . . . 0.0 110.316 179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.858 HD13 ' HD2' ' A' ' 24' ' ' LYS . 70.6 mt -82.37 -37.09 26.14 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -171.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.498 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 82.6 mtp180 -77.08 -7.41 55.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.076 0.465 . . . . 0.0 110.377 -179.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -102.51 -43.85 5.52 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.507 173.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -137.51 102.51 4.79 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.987 178.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -63.56 -26.62 68.78 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.765 0.317 . . . . 0.0 111.259 -179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -128.15 89.5 49.93 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 173.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_exo -67.16 66.68 0.63 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.367 2.711 . . . . 0.0 113.408 -177.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -86.53 -41.94 13.93 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.729 175.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.13 -0.938 . . . . 0.0 111.233 178.713 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.485 1.298 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . 0.534 ' C ' ' HG3' ' A' ' 57' ' ' GLU . 57.2 tp -160.98 -49.36 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.455 0.169 . . . . 0.0 111.048 -179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -143.11 50.41 1.42 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.547 0.213 . . . . 0.0 111.268 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 46.9 t -60.31 -51.94 67.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.919 0.39 . . . . 0.0 110.582 176.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 13.6 p -157.59 128.49 6.57 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.562 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp -120.83 127.18 75.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.185 0.517 . . . . 0.0 110.933 177.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.422 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.3 t -114.92 104.09 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.359 -175.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.611 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 17.1 ttmm -90.12 109.59 20.65 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 171.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -124.65 137.84 54.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 175.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.411 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 26.4 mtpp -88.76 122.45 32.18 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -97.77 106.67 35.26 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 -178.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 15.5 Cg_exo -68.53 108.94 1.94 Allowed 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.835 2.356 . . . . 0.0 112.372 -178.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 10.3 mp -63.78 -48.07 80.2 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.387 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -79.46 67.86 8.47 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 121.706 1.604 . . . . 0.0 111.506 173.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.1 tp -60.75 -33.27 72.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.095 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 17.9 p -116.57 91.69 3.66 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.064 173.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.432 ' HB3' ' HD3' ' B' ' 216' ' ' PRO . 10.0 tt0 -63.23 -50.81 73.29 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.619 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . 0.432 ' HD3' ' HB3' ' B' ' 215' ' ' GLN . 97.0 Cg_endo -78.39 34.86 0.51 Allowed 'Trans proline' 0 C--N 1.357 1.024 0 C-N-CA 122.046 1.831 . . . . 0.0 112.273 176.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.969 0 CA-C-O 119.098 -0.834 . . . . 0.0 111.278 -177.659 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 120.646 0.26 . . . . 0.0 110.948 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -67.58 -34.15 76.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -173.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -65.04 -44.95 87.39 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.895 0.379 . . . . 0.0 110.513 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -72.17 -40.45 67.93 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.29 -177.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.49 -56.82 5.67 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.554 0.205 . . . . 0.0 111.554 -177.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -72.6 -38.27 67.88 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.696 -0.229 . . . . 0.0 110.776 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m 66.24 99.58 0.05 OUTLIER 'General case' 0 C--O 1.234 0.283 0 O-C-N 123.519 0.512 . . . . 0.0 111.528 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -65.8 147.18 98.88 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.341 174.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -72.07 140.55 34.71 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.594 2.196 . . . . 0.0 111.252 176.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.497 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -79.63 120.2 23.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.297 -177.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.9 p -69.92 179.45 2.26 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.51 -50.81 72.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 121.273 -0.171 . . . . 0.0 110.981 -173.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -56.8 -41.76 78.31 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 120.834 0.35 . . . . 0.0 111.073 178.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.29 -44.96 93.53 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.731 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.497 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.9 mttt -62.7 -41.04 98.92 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.688 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttp85 -64.36 -43.15 95.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.107 0.48 . . . . 0.0 110.107 176.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -61.24 -41.73 97.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.739 179.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.774 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -68.99 -32.6 72.28 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.103 -176.04 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.6 p -68.38 -26.76 65.73 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.624 -0.673 . . . . 0.0 109.925 174.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.7 mt -83.8 -39.18 20.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.691 -179.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.774 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 2.5 p30 -66.17 -41.1 90.78 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.833 -0.347 . . . . 0.0 110.896 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 43.8 mt -60.94 -40.31 84.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.981 0.42 . . . . 0.0 110.096 176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -66.67 -29.07 68.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.039 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 48.6 mttp -66.25 -28.65 68.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.107 174.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.657 HD11 HG12 ' A' ' 71' ' ' VAL . 94.5 mt -76.39 135.84 68.83 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.385 -171.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.481 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 86.7 Cg_endo -81.72 171.94 12.73 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.265 2.643 . . . . 0.0 112.531 177.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.83 -45.11 61.32 Favored Glycine 0 CA--C 1.521 0.456 0 N-CA-C 114.333 0.493 . . . . 0.0 114.333 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -46.66 -52.69 13.22 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.532 0.682 . . . . 0.0 111.478 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.497 ' HE3' ' SG ' ' A' ' 74' ' ' CYS . 1.7 mptp? -80.47 -29.24 37.44 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.057 -176.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.55 HD21 ' CD1' ' B' ' 207' ' ' PHE . 12.9 tp -63.19 -24.28 67.81 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 120.825 0.345 . . . . 0.0 110.2 178.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.76 -37.02 94.14 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 111.807 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.481 ' O ' HG13 ' A' ' 36' ' ' ILE . 7.7 tpp180 -75.47 -39.02 59.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 176.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.442 HG13 HD22 ' A' ' 67' ' ' LEU . 60.0 t -57.33 -55.01 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.076 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.1 p -64.49 -30.81 51.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.022 0.439 . . . . 0.0 110.482 -178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -64.29 -41.54 96.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.153 176.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 32' ' ' ARG . 67.7 mt -63.76 -47.35 91.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.396 178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 33' ' ' VAL . 46.5 mt -63.95 -59.56 4.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.341 -177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -60.58 -31.29 70.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 t -77.99 -39.53 42.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.891 -0.324 . . . . 0.0 111.401 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 8.7 mpt_? -76.06 -28.58 57.68 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.073 0.463 . . . . 0.0 110.447 176.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -116.9 78.98 9.76 Favored Pre-proline 0 N--CA 1.44 -0.929 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.468 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -63.27 -15.66 49.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.18 1.92 . . . . 0.0 112.391 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 21.3 t -73.08 -12.72 61.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.133 176.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.9 mt -108.09 23.31 14.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -65.29 -31.6 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.725 0.297 . . . . 0.0 111.262 -178.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -85.65 41.95 0.93 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.255 0.55 . . . . 0.0 110.735 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.0 m -84.5 99.99 11.07 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -52.81 117.01 10.05 Favored Pre-proline 0 CA--C 1.523 -0.093 0 O-C-N 123.75 0.656 . . . . 0.0 110.233 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.97 -31.74 45.0 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.701 2.934 . . . . 0.0 114.222 -172.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -73.87 -27.74 61.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.2 -176.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -141.49 79.18 1.67 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.152 0.501 . . . . 0.0 109.652 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.418 HD12 ' CE1' ' B' ' 207' ' ' PHE . 50.5 mt -89.84 126.55 42.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.501 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 33.9 mm-40 -98.78 123.34 42.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.917 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.4 mt -98.01 108.59 22.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 170.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -108.92 100.8 9.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 122.141 0.972 . . . . 0.0 110.587 175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.3 m-85 -70.58 -2.85 15.5 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.546 -1.206 . . . . 0.0 112.128 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -83.0 -23.29 33.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.859 0.362 . . . . 0.0 110.811 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 62.0 p -97.98 -26.67 14.56 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.958 0.409 . . . . 0.0 110.095 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.2 mt -58.75 127.53 32.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.047 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -69.76 147.8 96.4 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 176.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -44.19 -34.82 7.29 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.54 2.16 . . . . 0.0 113.095 173.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 65.6 m -56.69 -51.71 67.75 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.145 175.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -63.37 -45.65 90.14 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.261 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 68.7 mt -59.07 -35.09 72.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.717 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -71.54 -51.54 22.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.121 178.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -57.49 -42.86 83.51 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.802 0.334 . . . . 0.0 110.543 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.582 ' O ' HG13 ' A' ' 71' ' ' VAL . 78.8 mt -58.69 -58.96 6.28 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.6 177.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -57.21 -45.42 83.84 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.765 0.317 . . . . 0.0 111.297 -178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -58.54 -38.63 78.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.27 0.557 . . . . 0.0 110.612 -179.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -75.59 -47.89 24.67 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.653 -177.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.676 HG21 ' CG ' ' A' ' 21' ' ' ASP . 11.5 m -62.9 -39.85 86.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.069 0.461 . . . . 0.0 110.396 -176.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 31.6 p -68.67 -30.81 69.58 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.105 -178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 85.6 p -68.96 -23.19 64.11 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.377 178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.497 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 45.6 t -92.43 -44.95 8.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.121 0.486 . . . . 0.0 110.542 -179.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.562 HD21 HD23 ' A' ' 25' ' ' LEU . 27.9 mt -83.41 -33.76 25.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.574 -171.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.533 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.3 mtp180 -78.31 -1.56 33.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.249 0.547 . . . . 0.0 110.05 176.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 tttp -104.97 -34.32 8.05 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.253 172.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -150.6 104.29 3.19 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.104 176.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.2 ptt180 -66.47 111.13 3.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.265 176.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? 60.72 79.07 0.29 Allowed Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.335 -175.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -70.34 99.82 0.84 Allowed 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 122.928 2.419 . . . . 0.0 112.47 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -101.66 97.74 8.12 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.876 175.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.822 -177.076 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 96.0 mt -135.19 60.13 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . 0.422 ' HB3' HD11 ' B' ' 204' ' ' ILE . 76.6 mt-30 -138.69 72.69 1.41 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.328 -174.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 11.6 t -75.59 -38.35 59.16 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.015 0.436 . . . . 0.0 109.853 177.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 9.2 p -165.03 130.71 2.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.149 177.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . 0.422 HD11 ' HB3' ' B' ' 201' ' ' GLN . 4.3 mp -125.35 120.53 58.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.199 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.469 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 60.4 t -104.05 109.18 26.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.136 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.501 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.1 ttmm -99.75 81.9 2.53 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.55 ' CD1' HD21 ' A' ' 30' ' ' LEU . 7.5 p90 -93.35 159.19 15.37 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.003 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.427 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 25.2 ttmm -110.13 119.95 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.59 107.96 33.79 Favored Pre-proline 0 C--N 1.325 -0.473 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 23.4 Cg_exo -64.47 118.97 5.9 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.74 2.294 . . . . 0.0 111.769 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 61.1 tp -108.73 106.29 58.5 Favored Pre-proline 0 C--N 1.32 -0.714 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.637 179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.64 56.86 2.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.807 2.338 . . . . 0.0 111.915 178.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.5 tp -147.97 -57.19 0.23 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.5 p -76.8 -46.7 23.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.627 172.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -120.59 87.45 41.58 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.66 173.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -48.7 -39.38 38.16 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.395 2.73 . . . . 0.0 113.289 -179.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.788 0 CA-C-O 119.095 -0.836 . . . . 0.0 111.364 178.494 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.3 t . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.949 0.404 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -62.97 -29.37 70.76 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.856 -174.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -69.73 -45.97 66.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.462 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -67.79 -26.95 66.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.248 0.547 . . . . 0.0 110.982 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -80.81 -31.64 35.57 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.051 0.453 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -69.55 -37.67 77.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.72 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.6 ' SG ' ' HB2' ' A' ' 65' ' ' ARG . 52.8 t -151.54 137.27 17.96 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.526 179.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -85.23 145.31 42.54 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.027 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -64.23 127.45 19.24 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.85 2.367 . . . . 0.0 111.69 -176.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.433 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.5 mmt -61.27 128.86 38.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.226 -179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 55.6 p -75.0 176.73 6.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -58.07 -48.23 80.76 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -53.31 -46.84 69.57 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.364 -179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -67.27 -45.23 77.26 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.864 -175.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 10' ' ' MET . 91.9 mttt -56.46 -38.56 71.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.18 175.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.3 ttp180 -60.93 -45.31 95.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.314 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -62.95 -39.94 96.15 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.591 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.615 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -69.07 -30.64 69.01 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.202 -178.269 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.532 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 80.9 p -69.71 -30.03 67.56 Favored 'General case' 0 C--N 1.318 -0.802 0 O-C-N 121.431 -0.793 . . . . 0.0 110.011 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 68.6 mt -80.25 -39.18 29.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.608 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.615 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.3 p30 -68.0 -42.48 80.65 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.397 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.6 mt -59.5 -39.36 79.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.564 -0.455 . . . . 0.0 110.558 177.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -67.16 -30.86 70.95 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.902 0.382 . . . . 0.0 111.138 -179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HB3' HD22 ' A' ' 75' ' ' LEU . 77.4 mttt -62.54 -30.04 71.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.842 175.07 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.682 HD11 HG12 ' A' ' 71' ' ' VAL . 95.9 mt -73.36 139.28 78.44 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.381 -172.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -81.03 170.28 15.34 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.127 2.552 . . . . 0.0 112.866 177.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.79 -46.26 48.49 Favored Glycine 0 C--N 1.333 0.39 0 O-C-N 123.368 0.418 . . . . 0.0 113.649 -174.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 1.6 mp0 -47.03 -56.87 5.71 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.265 0.555 . . . . 0.0 110.988 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -27.09 61.64 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.52 -176.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.5 mt -62.2 -25.16 67.64 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.773 0.32 . . . . 0.0 110.547 178.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.93 -36.38 92.74 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.073 174.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 32' ' ' ARG . 5.4 tpp180 -76.8 -40.19 48.94 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.666 0.27 . . . . 0.0 110.537 177.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.451 HG13 HD22 ' A' ' 67' ' ' LEU . 58.0 t -57.75 -54.07 36.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.897 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.9 p -64.31 -29.84 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.573 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -63.87 -45.29 90.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.644 176.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 75.9 mt -63.7 -47.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.845 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.6 mt -62.63 -58.99 5.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.768 -178.369 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -62.74 -30.98 71.84 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -175.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.3 t -70.39 -50.73 35.62 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.602 0.239 . . . . 0.0 110.895 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -69.29 -30.85 69.02 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.862 0.363 . . . . 0.0 110.94 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.42 ' CD ' ' HZ3' ' A' ' 60' ' ' LYS . 15.9 mm-40 -116.97 81.29 12.14 Favored Pre-proline 0 N--CA 1.443 -0.783 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.649 -178.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -63.03 -18.38 64.92 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.4 2.066 . . . . 0.0 113.104 -177.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.7 t -70.42 -27.79 64.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.036 0.446 . . . . 0.0 110.114 177.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.38 23.27 1.63 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.833 -177.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 tptp -72.03 -13.0 61.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.365 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -85.14 4.8 32.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.286 0.565 . . . . 0.0 110.621 -177.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.4 m -66.86 104.7 1.41 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.159 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.54 123.66 71.89 Favored Pre-proline 0 CA--C 1.52 -0.2 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 173.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.75 -14.28 17.12 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.001 2.468 . . . . 0.0 112.409 178.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.04 -33.64 22.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.928 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -137.29 68.02 1.42 Allowed 'General case' 0 C--O 1.227 -0.112 0 CA-C-O 120.713 0.292 . . . . 0.0 110.758 -178.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.442 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.9 mt -78.42 122.09 32.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.346 -175.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -102.34 122.13 43.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.558 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 40.0 mt -93.63 109.0 21.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 175.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -105.42 95.51 5.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.14 0.972 . . . . 0.0 110.627 176.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -66.47 -5.27 10.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.28 -175.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -82.23 -27.97 32.18 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.634 0.254 . . . . 0.0 110.944 -177.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.3 p -93.05 -22.48 19.11 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.418 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 27.1 mt -59.9 131.8 51.99 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.078 178.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.42 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 11.8 mtmm -82.79 153.84 67.66 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.119 -179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.2 -43.94 24.83 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.446 2.097 . . . . 0.0 113.057 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 70.6 m -52.23 -52.0 54.96 Favored 'General case' 0 N--CA 1.463 0.188 0 O-C-N 123.147 0.279 . . . . 0.0 111.153 177.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -60.75 -45.68 93.39 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.545 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 64.0 mt -60.9 -36.83 80.27 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.01 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.6 ' HB2' ' SG ' ' A' ' 7' ' ' CYS . 32.1 tpt180 -70.75 -50.33 37.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 177.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 62' ' ' SER . 60.0 mm-40 -59.05 -41.05 86.96 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.905 0.383 . . . . 0.0 110.225 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 71' ' ' VAL . 80.1 mt -61.91 -58.16 9.0 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.692 176.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.48 -45.23 73.16 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.056 -179.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -61.86 -36.23 80.61 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.924 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.413 ' CE1' ' HG2' ' A' ' 32' ' ' ARG . 69.6 t80 -75.78 -49.11 19.06 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.549 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.682 HG12 HD11 ' A' ' 25' ' ' LEU . 13.7 m -62.65 -40.36 88.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.122 0.486 . . . . 0.0 110.537 -175.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.415 ' HB ' ' HD3' ' A' ' 76' ' ' ARG . 29.1 p -65.63 -35.14 79.92 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.082 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.9 p -66.0 -24.77 66.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.787 0.327 . . . . 0.0 110.624 -179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 44.0 t -91.33 -41.99 10.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.743 0.306 . . . . 0.0 110.579 -179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.546 HD21 HD23 ' A' ' 25' ' ' LEU . 29.8 mt -89.7 -38.36 13.93 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -168.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.415 ' HD3' ' HB ' ' A' ' 72' ' ' THR . 39.6 mtp180 -73.28 -4.71 34.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.853 0.835 . . . . 0.0 109.227 177.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -99.93 -47.14 5.13 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.25 -1.341 . . . . 0.0 109.132 170.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 23.6 tptt -154.06 108.07 3.0 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.895 178.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -64.56 -25.12 67.84 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 121.193 0.52 . . . . 0.0 110.817 -178.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -138.31 89.25 14.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.492 172.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -52.62 123.08 12.06 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.363 2.709 . . . . 0.0 112.705 -176.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -158.63 99.87 1.59 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.874 -179.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.53 -0.747 . . . . 0.0 110.086 179.058 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.961 0.41 . . . . 0.0 110.875 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 92.2 mt -77.45 93.84 4.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.872 177.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -152.84 123.45 7.28 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.162 0.506 . . . . 0.0 111.099 -175.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 4.2 p -89.61 -41.89 11.71 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.028 175.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 33.5 t -165.39 99.27 0.71 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.877 176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.1 pp -87.69 105.16 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.794 0.807 . . . . 0.0 111.401 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.532 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 57.7 t -87.8 113.47 25.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.103 -176.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 19.7 ttmm -96.51 113.77 25.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.73 175.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -125.38 139.73 53.41 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.351 0.596 . . . . 0.0 110.6 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.515 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 62.7 mttm -89.81 122.51 32.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.316 -0.856 . . . . 0.0 108.696 175.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -97.71 102.39 13.08 Favored Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 52.6 Cg_exo -53.85 106.35 0.16 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 123.332 2.688 . . . . 0.0 112.662 -174.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.9 -51.26 72.53 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -77.29 68.79 7.37 Favored 'Trans proline' 0 C--N 1.354 0.849 0 C-N-CA 122.0 1.8 . . . . 0.0 112.468 177.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 52.7 tp -78.67 88.6 4.56 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 176.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 17.0 m -74.39 -39.05 62.93 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.011 -176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -130.67 108.63 15.75 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.435 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.21 60.28 6.25 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 122.905 2.404 . . . . 0.0 112.096 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.405 -1.219 . . . . 0.0 111.653 179.017 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.9 m . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.947 0.403 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -84.23 -26.61 28.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.077 -178.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -55.35 -44.89 76.37 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.541 -177.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -62.52 -20.39 64.59 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.564 ' O ' ' HE3' ' A' ' 8' ' ' LYS . 36.5 t70 -85.02 -19.11 32.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.097 0.475 . . . . 0.0 110.602 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -105.45 -35.1 7.6 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.097 0.475 . . . . 0.0 110.202 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.478 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 55.7 m -104.94 97.69 7.51 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.339 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.564 ' HE3' ' O ' ' A' ' 5' ' ' ASP . 1.4 mptm? -87.4 143.91 34.98 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.785 177.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -61.08 123.31 12.64 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.795 2.33 . . . . 0.0 111.433 -177.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.4 mmt -62.81 130.12 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.634 -176.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.0 m -90.14 177.68 6.37 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -57.64 -54.11 50.58 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -165.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -48.99 -41.26 33.76 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 178.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.41 -48.39 70.2 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.694 -179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.44 ' HE3' ' O ' ' A' ' 10' ' ' MET . 95.0 mttt -57.58 -40.73 79.66 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.279 178.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 41.3 ttp180 -63.78 -47.07 82.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.335 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -60.33 -46.11 91.05 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.19 -48.21 82.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.471 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.589 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 76.7 p -60.81 -32.99 72.33 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.144 0.497 . . . . 0.0 110.753 -179.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.7 mt -76.68 -34.93 58.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.547 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.468 ' HB3' HD12 ' A' ' 75' ' ' LEU . 64.0 m-20 -68.91 -41.93 77.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.228 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 37.5 mt -60.16 -35.22 60.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.948 0.404 . . . . 0.0 110.664 176.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -73.95 -24.88 59.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.764 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.6 mttp -66.33 -42.84 87.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.295 0.569 . . . . 0.0 110.363 172.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD11 HG12 ' A' ' 71' ' ' VAL . 96.1 mt -58.41 136.04 85.45 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.651 -174.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.575 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.1 Cg_endo -80.3 172.43 13.7 Favored 'Trans proline' 0 CA--C 1.533 0.458 0 C-N-CA 123.381 2.72 . . . . 0.0 112.88 177.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -51.46 -46.3 52.86 Favored Glycine 0 CA--C 1.521 0.436 0 O-C-N 123.328 0.393 . . . . 0.0 114.034 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -48.71 -58.21 5.11 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.208 0.528 . . . . 0.0 111.843 -179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.575 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.3 mptp? -71.22 -23.91 62.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.964 -175.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.5 mt -63.63 -26.72 68.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.336 177.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.34 -34.63 89.87 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.026 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.405 ' O ' HG13 ' A' ' 36' ' ' ILE . 22.6 tpp180 -78.76 -41.0 31.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.538 0.209 . . . . 0.0 110.578 177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 HD22 ' A' ' 67' ' ' LEU . 95.6 t -55.97 -55.53 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.004 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.97 -31.8 53.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.604 -179.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 10.7 t60 -64.95 -41.09 95.8 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.884 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 32' ' ' ARG . 69.7 mt -64.95 -44.93 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.582 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.177 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 33' ' ' VAL . 54.6 mt -62.25 -61.64 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.972 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -61.78 -31.83 72.06 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 -173.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.9 t -79.81 -30.93 40.65 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.698 -177.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -83.96 -25.32 30.16 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.0 110.227 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 mm-40 -118.06 81.68 16.6 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.508 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -63.89 -16.18 53.33 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.694 2.263 . . . . 0.0 113.116 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 m -78.48 -8.4 58.5 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.013 0.435 . . . . 0.0 110.317 176.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.6 mt -110.07 28.81 8.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.228 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -81.81 -8.33 59.68 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.469 0.652 . . . . 0.0 110.514 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -103.4 30.46 4.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.708 176.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 75.0 m -72.48 110.88 7.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.578 178.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.79 118.6 13.73 Favored Pre-proline 0 N--CA 1.464 0.26 0 O-C-N 123.204 0.315 . . . . 0.0 110.202 175.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -62.99 -13.03 32.61 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.705 2.27 . . . . 0.0 111.109 175.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' B' ' 208' ' ' LYS . 4.3 m-20 -78.29 -37.46 44.84 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.16 -178.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -144.11 60.94 1.36 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.502 0.191 . . . . 0.0 110.993 -176.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 16.2 mt -63.21 123.48 16.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.039 0.447 . . . . 0.0 111.898 -173.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' B' ' 206' ' ' LYS . 41.0 mm-40 -100.7 116.96 33.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.432 179.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' B' ' 205' ' ' VAL . 37.6 mt -95.35 107.25 19.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 174.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -107.48 98.38 8.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.907 0.861 . . . . 0.0 110.273 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -68.59 -6.07 23.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.867 -1.061 . . . . 0.0 112.162 -174.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -76.8 -31.11 56.75 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.77 0.319 . . . . 0.0 110.84 179.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.6 p -93.32 -22.82 18.73 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 27.6 mt -61.43 131.56 50.6 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.11 179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -74.29 152.8 88.11 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.079 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -49.27 -34.88 32.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.599 2.199 . . . . 0.0 111.939 174.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.5 m -56.79 -52.4 65.18 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.252 177.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.18 -47.86 75.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.616 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.7 mt -57.02 -35.3 69.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.15 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.478 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 27.9 tpt180 -73.35 -49.97 24.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.779 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -63.63 -41.51 98.25 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.782 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.58 ' O ' HG13 ' A' ' 71' ' ' VAL . 83.3 mt -58.33 -55.87 29.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.334 176.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -55.81 -47.75 76.62 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.882 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 -57.65 -38.15 74.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.097 0.475 . . . . 0.0 110.873 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -75.61 -49.28 18.96 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.589 -177.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.58 HG13 ' O ' ' A' ' 67' ' ' LEU . 6.3 m -63.91 -39.85 86.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.763 0.316 . . . . 0.0 110.27 -175.424 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 25.6 p -67.04 -35.64 80.33 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.11 -178.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 59.7 p -67.91 -24.51 65.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.83 0.348 . . . . 0.0 110.866 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.487 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 35.1 t -91.96 -26.26 18.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.05 0.452 . . . . 0.0 110.814 -178.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 HD23 ' A' ' 25' ' ' LEU . 31.1 mt -103.45 -44.99 4.98 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -171.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 71.0 mtp180 -69.88 -16.09 63.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.186 0.517 . . . . 0.0 110.74 -178.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.63 -13.53 58.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.043 176.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 79' ' ' ARG . 2.3 tppp? -148.31 -94.48 0.08 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.406 -178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.418 ' H ' ' HB3' ' A' ' 78' ' ' LYS . 38.1 ptt180 171.41 -47.68 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.531 0.733 . . . . 0.0 109.659 178.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -154.53 95.53 2.68 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.609 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -73.15 110.8 3.13 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 122.246 1.964 . . . . 0.0 112.006 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -86.12 65.67 9.2 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.645 0.736 . . . . 0.0 109.342 175.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.033 -0.984 . . . . 0.0 109.993 -178.611 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 120.718 0.294 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.63 -24.34 17.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.921 0.391 . . . . 0.0 111.0 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -120.47 97.26 5.48 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.589 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 6.4 p -88.83 -169.68 2.62 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.386 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 37.6 t -71.92 95.59 1.58 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.789 0.328 . . . . 0.0 110.602 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 32.4 mm -83.23 130.04 36.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 178.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.589 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 60.4 t -109.64 129.74 63.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.253 -173.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 53' ' ' GLU . 37.6 ttmt -118.25 117.66 29.72 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 176.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.403 ' CE2' HD11 ' A' ' 54' ' ' ILE . 23.2 p90 -133.42 145.08 49.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.252 0.549 . . . . 0.0 111.274 -178.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 55.9 mttp -89.25 128.5 35.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.294 173.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -109.11 107.83 60.1 Favored Pre-proline 0 C--N 1.322 -0.602 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.443 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -64.37 130.58 27.28 Favored 'Trans proline' 0 N--CA 1.463 -0.315 0 C-N-CA 122.671 2.247 . . . . 0.0 111.464 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 80.2 mt 63.42 88.6 0.12 Allowed Pre-proline 0 C--O 1.233 0.187 0 O-C-N 123.751 0.657 . . . . 0.0 110.611 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -59.04 -59.58 0.44 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.129 2.552 . . . . 0.0 112.291 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 33.1 tp -159.78 52.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 22.8 p -79.81 -68.25 0.69 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.846 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . 0.414 ' HA ' ' HD3' ' B' ' 216' ' ' PRO . 28.4 tt0 -146.19 124.83 6.44 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 -177.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 215' ' ' GLN . 3.7 Cg_exo -77.97 54.31 4.81 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.811 2.34 . . . . 0.0 111.28 173.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -1.28 . . . . 0.0 111.487 -177.431 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 N--CA 1.477 0.877 0 CA-C-O 120.581 0.229 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -57.2 -40.22 77.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.779 -176.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -72.97 -37.2 67.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.07 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -76.84 -31.49 56.91 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.948 0.404 . . . . 0.0 110.612 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.55 -27.37 64.09 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.531 0.682 . . . . 0.0 109.832 175.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -74.41 -14.26 60.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.054 177.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 85.3 m -91.77 103.04 15.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.909 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.03 148.34 47.66 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.093 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -62.18 129.8 28.35 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.0 2.467 . . . . 0.0 112.399 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.45 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -66.31 132.7 48.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.48 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 38.6 p -75.44 177.04 6.96 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 176.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -60.3 -47.81 84.45 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.285 -174.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -53.68 -47.05 70.8 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.345 0.593 . . . . 0.0 109.874 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.26 -46.86 84.88 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.652 -176.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 10' ' ' MET . 93.2 mttt -58.19 -40.01 80.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.154 176.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -63.25 -42.94 99.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.547 175.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -64.37 -36.06 82.91 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.943 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.735 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.42 -31.8 69.14 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.735 178.818 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.529 ' HB2' ' CG2' ' B' ' 205' ' ' VAL . 60.4 p -70.0 -25.32 63.55 Favored 'General case' 0 C--N 1.321 -0.653 0 O-C-N 121.569 -0.707 . . . . 0.0 110.001 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.1 mt -85.3 -39.27 17.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.334 -178.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.735 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -67.61 -41.27 84.27 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 120.922 -0.311 . . . . 0.0 110.804 177.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -60.17 -38.6 77.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.171 0.51 . . . . 0.0 110.15 174.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -68.35 -31.15 70.34 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.753 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 21' ' ' ASP . 47.6 mttp -63.39 -38.87 92.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.024 173.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.631 HD11 HG12 ' A' ' 71' ' ' VAL . 94.3 mt -64.38 135.17 96.24 Favored Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 115.189 -0.914 . . . . 0.0 112.681 -173.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.547 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 90.4 Cg_endo -80.36 172.78 13.21 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.533 2.822 . . . . 0.0 113.012 177.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.8 -46.93 48.18 Favored Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.275 0.47 . . . . 0.0 114.275 -172.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.56 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 2.1 mp0 -48.74 -52.6 22.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.683 0.754 . . . . 0.0 111.335 -178.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.547 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.5 mptp? -76.4 -24.36 54.07 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.193 -173.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.87 -29.19 68.14 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.046 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.04 -43.72 99.08 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.969 -0.634 . . . . 0.0 111.783 176.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.592 ' HE ' HG13 ' A' ' 36' ' ' ILE . 7.6 tpm_? -68.47 -42.11 79.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.686 0.279 . . . . 0.0 110.66 177.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.597 HG13 HD22 ' A' ' 67' ' ' LEU . 88.3 t -58.17 -58.03 8.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.927 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.5 p -62.45 -29.53 47.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.514 -177.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -69.63 -41.82 75.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.323 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.592 HG13 ' HE ' ' A' ' 32' ' ' ARG . 64.4 mt -61.69 -41.83 91.95 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 175.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.479 HG23 HD21 ' A' ' 59' ' ' LEU . 72.7 mt -62.7 -60.45 2.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.002 178.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -64.49 -35.1 79.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -174.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.9 t -72.53 -42.89 64.24 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.988 -178.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.27 -35.81 71.5 Favored 'General case' 0 CA--C 1.514 -0.404 0 C-N-CA 120.931 -0.307 . . . . 0.0 110.557 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.517 ' HG3' HD23 ' A' ' 59' ' ' LEU . 55.6 mm-40 -114.73 86.14 12.53 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.776 -178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -64.25 -16.26 54.07 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.233 1.956 . . . . 0.0 112.365 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.3 m -77.36 -12.27 59.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.923 0.392 . . . . 0.0 110.711 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 61.4 mt -99.99 26.44 6.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.123 0.487 . . . . 0.0 110.498 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 78.1 tttt -70.52 -15.11 62.76 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.437 -178.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -81.06 11.82 3.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 59.5 m -72.57 94.37 1.69 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.401 176.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -64.3 119.36 55.56 Favored Pre-proline 0 C--N 1.33 -0.258 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -49.84 -31.33 26.08 Favored 'Trans proline' 0 N--CA 1.476 0.452 0 C-N-CA 123.872 3.048 . . . . 0.0 114.651 -174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -74.61 -28.99 61.13 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 121.134 -0.227 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -140.3 72.95 1.41 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 -175.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.533 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 26.8 mt -87.3 126.1 41.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-O 120.798 0.332 . . . . 0.0 111.377 -176.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.421 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 35.8 mm-40 -103.43 116.22 32.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.897 178.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.458 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 54.0 mt -88.99 108.36 18.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -107.88 100.2 9.59 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 122.135 0.969 . . . . 0.0 110.466 175.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -67.22 -10.12 47.34 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.235 -174.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.1 mm-40 -77.15 -30.21 54.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.098 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.4 p -89.31 -26.58 21.04 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 109.922 177.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.517 HD23 ' HG3' ' A' ' 41' ' ' GLU . 39.7 mt -59.0 126.97 29.91 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.822 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.413 ' HZ3' ' CD ' ' A' ' 41' ' ' GLU . 20.4 mtmm -68.6 151.11 97.43 Favored Pre-proline 0 C--N 1.328 -0.367 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 175.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -46.94 -34.76 17.03 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.522 2.148 . . . . 0.0 112.436 174.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -55.92 -56.21 23.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.495 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.3 m -58.87 -46.29 88.14 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.677 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.5 mt -58.57 -35.76 72.89 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.974 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.465 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 31.0 tpt180 -76.39 -47.39 23.42 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.001 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -60.33 -42.65 96.11 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.771 0.32 . . . . 0.0 110.42 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.597 HD22 HG13 ' A' ' 33' ' ' VAL . 80.2 mt -59.49 -58.27 9.36 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.482 175.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -54.38 -47.15 73.02 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.279 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 61.5 ttt180 -58.03 -37.45 74.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.206 0.527 . . . . 0.0 110.56 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.437 ' O ' ' HB3' ' A' ' 73' ' ' SER . 62.8 t80 -74.77 -47.53 30.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.764 -179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.645 HG21 ' CG ' ' A' ' 21' ' ' ASP . 10.7 m -63.42 -40.96 90.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.002 0.43 . . . . 0.0 110.347 -176.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.48 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 32.3 p -67.59 -31.0 70.75 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.331 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 70' ' ' TYR . 45.2 t -59.96 -33.66 72.23 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.397 175.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.498 ' SG ' ' HE3' ' A' ' 29' ' ' LYS . 51.5 t -91.56 -36.13 13.87 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 120.736 0.303 . . . . 0.0 111.025 -175.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.519 HD21 HD23 ' A' ' 25' ' ' LEU . 21.0 mt -94.17 -29.43 15.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -170.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 72' ' ' THR . 72.2 mtp180 -76.23 -16.42 59.82 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -87.32 -57.6 2.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.133 171.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -129.73 101.07 5.73 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.893 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 37.5 ptt180 -67.73 116.45 8.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.958 0.409 . . . . 0.0 110.624 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 25.8 tptp 56.67 69.65 1.68 Allowed Pre-proline 0 CA--C 1.534 0.336 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.713 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -57.47 125.8 19.95 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.214 2.609 . . . . 0.0 113.246 -171.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -96.18 168.67 10.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.694 -0.684 . . . . 0.0 109.402 174.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.301 178.391 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 120.64 0.257 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 73.4 mt -82.61 75.19 9.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.919 0.39 . . . . 0.0 110.54 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.79 11.06 2.03 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.314 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 20.6 p -151.53 176.57 11.2 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.838 0.351 . . . . 0.0 111.02 -176.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 22.1 t -73.02 91.49 1.58 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.459 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 50.4 mt -86.1 112.45 22.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.039 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.529 ' CG2' ' HB2' ' A' ' 19' ' ' SER . 48.7 t -87.69 104.87 14.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.313 -175.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.533 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 3.9 ttmp? -91.73 103.98 16.49 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.473 173.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -116.65 151.57 36.02 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.383 178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -103.62 105.53 15.79 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.174 -178.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' B' ' 210' ' ' PRO . 55.2 tttp -75.35 115.68 47.59 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.325 -178.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 209' ' ' LYS . 16.8 Cg_exo -66.36 123.67 11.47 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.568 2.178 . . . . 0.0 111.841 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . 80.9 mt -117.81 79.26 13.1 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.16 177.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.75 133.96 10.61 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.174 1.916 . . . . 0.0 111.756 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 54.7 tp -89.73 -51.2 5.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.551 178.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . 0.462 ' O ' ' HD3' ' B' ' 216' ' ' PRO . 45.9 m 66.95 114.46 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 O-C-N 123.694 0.621 . . . . 0.0 111.471 179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -83.99 108.03 12.59 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.893 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' B' ' 214' ' ' THR . 94.3 Cg_endo -90.4 9.99 3.07 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.824 2.349 . . . . 0.0 113.096 -176.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.901 -0.944 . . . . 0.0 111.914 179.902 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.1 m . . . . . 0 N--CA 1.478 0.929 0 CA-C-O 120.48 0.181 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -99.1 -26.96 14.04 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 122.112 -0.367 . . . . 0.0 111.412 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -46.33 74.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.85 -173.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.463 ' HA ' ' O ' ' A' ' 7' ' ' CYS . 2.2 pm0 -74.08 -15.58 61.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.779 0.323 . . . . 0.0 111.004 -178.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -77.79 -35.69 51.19 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -83.09 -45.44 13.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.915 177.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' A' ' 4' ' ' GLU . 12.3 m -113.09 97.78 6.73 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 tttt -83.95 134.08 44.65 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-O 121.728 0.775 . . . . 0.0 112.429 -173.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -53.91 129.55 34.76 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 124.069 3.179 . . . . 0.0 112.197 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 23.5 mmt -66.24 149.19 50.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.725 -175.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 15' ' ' LYS . 19.1 p -86.06 172.74 10.38 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 171.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -60.28 -46.29 90.35 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 118.704 0.684 . . . . 0.0 109.314 -178.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -53.67 -48.13 69.76 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.177 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.43 -44.89 92.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.95 178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 11' ' ' SER . 45.3 mttp -59.58 -38.81 82.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.651 178.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 16' ' ' ARG . 40.3 ttp-105 -60.07 -42.14 93.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.074 0.464 . . . . 0.0 109.947 175.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -63.79 -39.21 93.71 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.468 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.812 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -70.62 -39.59 73.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.549 -178.533 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.455 ' HB2' HG21 ' B' ' 205' ' ' VAL . 85.7 p -61.45 -29.74 70.14 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.531 -0.731 . . . . 0.0 110.233 174.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 58.6 mt -78.58 -43.22 27.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.637 -178.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.812 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.8 p30 -63.12 -41.32 99.3 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.682 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.424 ' HA ' HD12 ' A' ' 25' ' ' LEU . 81.9 mt -59.31 -41.05 82.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.904 0.383 . . . . 0.0 110.68 178.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.421 HD22 ' HA ' ' A' ' 23' ' ' ASN . 8.1 m120 -72.09 -21.0 61.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.649 -179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 27.5 mtpp -84.94 -13.4 50.86 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.06 0.457 . . . . 0.0 110.248 177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.533 HD23 HD21 ' A' ' 75' ' ' LEU . 96.1 mt -81.73 136.73 47.88 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.978 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 84.0 Cg_endo -79.25 171.92 15.45 Favored 'Trans proline' 0 CA--C 1.532 0.375 0 C-N-CA 123.278 2.652 . . . . 0.0 112.941 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.86 -44.59 61.33 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 121.456 -0.402 . . . . 0.0 113.694 -175.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -48.52 -52.75 21.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 122.857 0.463 . . . . 0.0 110.809 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.591 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 2.9 mptp? -76.46 -28.18 56.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.234 -177.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' O ' HG12 ' A' ' 34' ' ' VAL . 10.8 mt -60.06 -30.25 69.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.877 178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.25 -39.81 96.52 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.961 -0.637 . . . . 0.0 111.822 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.407 ' O ' HG13 ' A' ' 36' ' ' ILE . 24.0 tpp180 -72.61 -42.92 63.97 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.411 -0.218 . . . . 0.0 110.411 177.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.542 ' O ' HG13 ' A' ' 37' ' ' ILE . 58.9 t -57.11 -54.78 25.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.836 179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.405 HG12 ' O ' ' A' ' 30' ' ' LEU . 12.0 p -65.72 -29.03 45.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.803 -178.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 9.7 t60 -64.84 -42.96 94.51 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 32' ' ' ARG . 75.6 mt -64.6 -43.18 96.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.263 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.542 HG13 ' O ' ' A' ' 33' ' ' VAL . 49.3 mt -63.22 -62.58 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.17 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.401 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 22.1 mt-30 -60.83 -36.72 79.82 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -174.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.9 t -68.86 -46.57 68.14 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.423 -177.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.38 -35.23 77.39 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.823 0.344 . . . . 0.0 110.663 178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.532 ' OE2' ' HG3' ' A' ' 60' ' ' LYS . 29.3 mm-40 -114.17 85.04 9.8 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.909 -174.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.35 -13.64 40.87 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.225 1.95 . . . . 0.0 111.789 175.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 m -79.2 -5.47 54.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.391 177.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 51.9 mt -108.91 33.18 4.38 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.237 0.542 . . . . 0.0 109.739 176.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -68.19 -17.84 64.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.425 -179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.44 41.85 1.01 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.203 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.401 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.8 m -98.67 88.1 3.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.119 0.485 . . . . 0.0 110.644 178.067 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 61.7 m-80 -68.87 124.33 90.02 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.802 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 53.8 Cg_exo -55.43 -21.68 31.09 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 123.429 2.752 . . . . 0.0 114.275 -174.233 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -72.62 -35.33 67.8 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -144.88 76.56 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.168 -175.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 27.0 mt -76.02 127.11 37.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.021 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -100.94 129.11 46.74 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.63 -179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 32.9 mt -110.23 108.43 25.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -110.05 102.65 11.35 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 122.046 0.927 . . . . 0.0 110.298 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -72.9 -13.65 61.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.547 -1.206 . . . . 0.0 112.628 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -77.58 -25.58 50.09 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.095 -0.242 . . . . 0.0 111.238 -177.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 46.5 p -91.49 -23.98 19.8 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.449 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 22.9 mt -59.5 130.2 45.71 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.63 176.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.532 ' HG3' ' OE2' ' A' ' 41' ' ' GLU . 19.8 mttm -73.24 148.49 88.65 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.541 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.41 -34.1 24.62 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.271 1.981 . . . . 0.0 112.248 174.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.3 t -57.12 -55.16 38.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.245 175.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -60.32 -47.7 84.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.777 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 mt -60.34 -37.08 79.54 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.117 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -68.43 -48.02 65.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.572 178.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -64.16 -44.65 91.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.88 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.519 HD22 HG13 ' A' ' 33' ' ' VAL . 94.1 mt -58.43 -56.08 26.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.352 177.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -55.48 -43.79 75.87 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.087 -178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -61.0 -41.91 97.44 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 0.0 111.043 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -71.82 -47.36 53.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.714 -176.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.548 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.5 m -63.75 -38.72 83.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.158 0.504 . . . . 0.0 110.976 -175.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.441 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 34.3 p -73.6 -31.61 63.66 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.488 ' O ' ' HD2' ' A' ' 77' ' ' LYS . 31.5 t -69.92 -19.41 63.39 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.256 177.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.591 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 38.4 t -90.46 -55.71 3.48 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.39 177.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.533 HD21 HD23 ' A' ' 25' ' ' LEU . 76.4 mt -77.68 -36.07 51.61 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -171.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 72' ' ' THR . 39.8 mtp180 -82.06 -6.37 59.11 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.807 -176.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.488 ' HD2' ' O ' ' A' ' 73' ' ' SER . 54.6 mttm -105.87 -20.34 13.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.204 173.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -157.92 99.15 1.67 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.301 179.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 79' ' ' ARG . 16.0 ptt180 -67.02 -26.37 66.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.64 -173.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -120.69 83.8 36.17 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-O 121.06 0.457 . . . . 0.0 110.125 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -65.64 108.47 1.24 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.834 2.356 . . . . 0.0 112.105 -177.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -92.39 123.45 35.72 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.287 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.685 -0.674 . . . . 0.0 110.119 177.676 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 120.81 0.338 . . . . 0.0 110.691 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 34.4 tp -150.18 -11.96 0.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.051 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 69.85 -59.03 0.51 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.56 0.744 . . . . 0.0 111.003 -175.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 66.0 p -151.76 149.95 29.62 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -51.31 115.39 1.56 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.875 0.735 . . . . 0.0 111.85 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 34.0 mt -95.18 116.99 38.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.764 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.455 HG21 ' HB2' ' A' ' 19' ' ' SER . 60.6 t -85.23 137.01 21.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.406 -173.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.59 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.7 mptp? -119.17 132.75 56.0 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 173.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -138.89 145.14 39.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.911 0.386 . . . . 0.0 110.236 174.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.453 ' O ' ' HD3' ' B' ' 210' ' ' PRO . 62.8 mttm -89.87 131.14 35.95 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.275 178.251 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -116.18 90.29 28.47 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.242 -175.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' B' ' 208' ' ' LYS . 2.0 Cg_endo -82.73 39.86 0.89 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 123.301 2.667 . . . . 0.0 112.078 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.453 ' HB2' ' HD3' ' B' ' 212' ' ' PRO . 88.5 mt -90.75 -52.8 0.3 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.925 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' B' ' 211' ' ' LEU . 73.0 Cg_endo -75.78 -8.1 18.92 Favored 'Trans proline' 0 C--N 1.357 0.978 0 C-N-CA 121.719 1.612 . . . . 0.0 111.346 173.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 46.0 tp -121.67 98.62 6.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.625 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 10.5 p -84.25 32.81 0.49 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.46 0.647 . . . . 0.0 111.079 -178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -122.91 94.15 47.65 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.571 178.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.63 165.77 29.73 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.381 -178.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.972 0 CA-C-O 118.54 -1.144 . . . . 0.0 111.604 178.672 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.479 1.014 0 CA-C-O 120.865 0.364 . . . . 0.0 110.697 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -86.81 -6.34 58.84 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -174.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -61.8 -53.64 53.11 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -71.7 -13.23 61.67 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.677 -177.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -71.94 -43.08 65.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.478 0.656 . . . . 0.0 109.35 175.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -82.6 -39.97 21.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.046 177.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 62.4 m -102.03 97.74 8.03 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.358 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -68.95 143.05 94.1 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.099 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.66 132.39 40.08 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.855 2.37 . . . . 0.0 111.27 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.513 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 26.3 mmt -65.61 126.52 28.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.267 -177.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 47.4 p -72.81 175.13 6.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.516 ' OH ' ' HA ' ' B' ' 202' ' ' SER . 2.0 t80 -59.67 -49.98 75.63 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.655 -174.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -55.59 -41.95 74.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.197 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -64.57 -45.79 85.51 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.925 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.513 ' HE3' ' O ' ' A' ' 10' ' ' MET . 92.0 mttt -59.94 -42.24 93.58 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.2 ttp180 -63.52 -40.29 96.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.376 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -61.33 -41.05 96.39 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.019 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.719 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.6 OUTLIER -68.87 -33.43 73.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.258 -179.613 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.492 ' HB2' HG22 ' B' ' 205' ' ' VAL . 80.1 p -68.56 -25.97 65.17 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 121.509 -0.744 . . . . 0.0 110.016 174.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 91.1 mt -86.33 -38.15 17.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.416 -177.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.719 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.6 p30 -68.17 -41.15 81.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.667 176.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.2 mt -60.59 -37.8 76.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.077 0.465 . . . . 0.0 110.364 175.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.32 -33.09 73.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.926 178.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 21' ' ' ASP . 52.1 mttp -62.56 -40.06 95.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.333 0.587 . . . . 0.0 110.469 174.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.623 HD23 HD21 ' A' ' 75' ' ' LEU . 91.4 mt -63.97 133.12 95.48 Favored Pre-proline 0 C--N 1.325 -0.476 0 CA-C-N 114.817 -1.083 . . . . 0.0 112.117 -175.083 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.526 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 85.3 Cg_endo -81.25 171.47 13.8 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 123.185 2.59 . . . . 0.0 112.951 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -50.6 -43.58 46.05 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 114.443 0.537 . . . . 0.0 114.443 -172.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.569 ' HB2' ' HD2' ' A' ' 29' ' ' LYS . 1.3 mp0 -51.76 -57.19 9.97 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.625 0.726 . . . . 0.0 110.797 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.592 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -71.68 -25.33 62.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.726 -176.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 30' ' ' LEU . 14.7 mt -64.29 -24.05 67.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.009 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.94 -33.79 88.14 Favored Glycine 0 C--N 1.335 0.487 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.103 174.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 10.6 tpp180 -79.17 -38.85 34.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.697 0.284 . . . . 0.0 110.356 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.482 HG13 HD22 ' A' ' 67' ' ' LEU . 60.3 t -59.29 -53.27 50.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.778 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.4 p -60.51 -33.45 54.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.993 0.425 . . . . 0.0 110.559 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -65.3 -44.44 87.9 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.173 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -63.47 -46.27 95.64 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.469 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 33' ' ' VAL . 48.2 mt -60.33 -65.71 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.892 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.471 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 0.0 OUTLIER -58.35 -33.33 69.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -176.589 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 41.1 t -74.27 -27.72 60.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.729 0.299 . . . . 0.0 111.092 -178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -89.2 -27.37 20.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.063 0.459 . . . . 0.0 110.472 174.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -119.93 87.05 37.67 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.802 -177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -66.67 -10.64 28.78 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.167 1.911 . . . . 0.0 111.869 173.85 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.2 m -85.84 4.44 37.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.495 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 33.8 mt -117.09 47.57 1.47 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.142 0.496 . . . . 0.0 110.588 177.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -90.75 -4.11 56.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.465 0.65 . . . . 0.0 110.037 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -77.66 -13.75 59.82 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.188 174.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.471 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 70.5 m -77.88 86.79 4.1 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.526 176.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -71.24 129.61 88.89 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-N 115.122 -0.944 . . . . 0.0 108.945 176.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.503 ' HA ' HD11 ' A' ' 52' ' ' ILE . 59.5 Cg_exo -47.58 -25.51 5.46 Favored 'Trans proline' 0 N--CA 1.479 0.675 0 C-N-CA 124.204 3.27 . . . . 0.0 115.083 -174.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -81.69 -23.26 36.95 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.443 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -144.65 77.89 1.55 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.142 0.496 . . . . 0.0 110.173 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.503 HD11 ' HA ' ' A' ' 49' ' ' PRO . 38.9 mt -91.01 129.4 41.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.437 -175.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.577 ' OE2' ' HG3' ' B' ' 206' ' ' LYS . 28.0 mm-40 -103.63 138.53 40.17 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.468 174.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 41.2 mt -112.81 108.89 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 173.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -111.94 99.0 7.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 122.06 0.933 . . . . 0.0 110.292 174.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -66.19 -12.64 57.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.586 -1.188 . . . . 0.0 112.129 -174.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -73.82 -26.97 60.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.913 -177.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.3 p -93.38 -26.32 17.31 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.47 132.4 53.87 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.132 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 19.4 mtmm -81.12 149.75 66.9 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.444 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_exo -43.82 -41.59 11.82 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 122.956 2.438 . . . . 0.0 112.867 177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -53.05 -54.08 40.7 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.716 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.5 m -61.31 -48.11 82.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.832 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 75.6 mt -58.01 -35.42 71.23 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.14 0.495 . . . . 0.0 110.976 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -73.64 -46.09 48.83 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.783 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -64.78 -42.88 94.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.644 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 71' ' ' VAL . 87.7 mt -57.38 -56.74 17.96 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.568 177.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.9 tt0 -55.4 -44.27 76.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.37 -37.77 78.76 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 110.912 -178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -78.39 -47.32 17.85 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.016 -177.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.61 HG12 HD11 ' A' ' 25' ' ' LEU . 15.4 m -61.46 -41.82 91.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.139 0.495 . . . . 0.0 110.399 -176.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 24.9 p -65.66 -35.72 81.59 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.932 -178.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.9 p -68.49 -23.24 64.54 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.853 -179.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.592 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 48.4 t -91.4 -29.54 17.02 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-O 120.87 0.367 . . . . 0.0 110.704 -179.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.623 HD21 HD23 ' A' ' 25' ' ' LEU . 34.8 mt -101.64 -37.1 8.5 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -80.89 -3.21 50.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.264 0.554 . . . . 0.0 110.633 -177.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -104.25 -20.91 13.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.076 170.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -161.22 98.42 1.16 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.764 -178.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -60.2 -25.89 65.95 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.862 0.363 . . . . 0.0 111.726 -176.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -127.58 86.77 57.67 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 176.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -63.57 94.7 0.18 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.889 2.393 . . . . 0.0 112.769 -177.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -82.86 -18.2 41.17 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.394 0.616 . . . . 0.0 109.676 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.91 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.231 175.666 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 . . . . . 0 N--CA 1.484 1.228 0 CA-C-O 120.873 0.368 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -90.32 125.24 35.46 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.86 0.362 . . . . 0.0 110.042 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -128.52 91.94 3.33 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.038 179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . 0.516 ' HA ' ' OH ' ' A' ' 12' ' ' TYR . 19.6 m -88.67 152.67 21.67 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.516 -178.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 34.2 m -72.31 90.92 1.29 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 45.8 mm -78.76 132.88 31.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.903 178.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.509 ' HB ' ' HB ' ' A' ' 54' ' ' ILE . 3.5 t -95.69 147.74 5.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.002 -177.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.577 ' HG3' ' OE2' ' A' ' 53' ' ' GLU . 22.8 ttmm -139.09 112.77 8.38 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.48 ' CE1' HD12 ' A' ' 52' ' ' ILE . 30.0 p90 -132.51 136.14 46.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.367 0.603 . . . . 0.0 111.017 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 6.5 mtpm? -98.94 90.46 4.65 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.346 179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp -67.32 132.31 93.27 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.145 -172.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.71 135.79 62.51 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.592 2.195 . . . . 0.0 111.58 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.483 ' H ' HD23 ' B' ' 211' ' ' LEU . 2.5 pt? -70.99 146.34 92.78 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.52 178.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -72.25 74.14 2.57 Favored 'Trans proline' 0 N--CA 1.465 -0.206 0 C-N-CA 122.607 2.205 . . . . 0.0 111.695 177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 4.1 pp -82.24 -12.39 58.1 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.251 -176.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 35.5 m -105.92 85.7 2.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.194 0.521 . . . . 0.0 110.567 177.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -133.63 100.89 13.32 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.017 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.79 116.56 3.19 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.13 2.553 . . . . 0.0 112.396 -178.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.14 0 CA-C-O 118.182 -1.343 . . . . 0.0 111.282 179.44 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.0 m . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 111.284 0.105 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -53.28 -53.41 51.24 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.89 0.376 . . . . 0.0 111.881 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -79.78 -23.35 42.23 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.631 -172.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.449 ' HA ' ' NH2' ' A' ' 65' ' ' ARG . 33.8 tt0 -73.08 -36.97 66.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.261 178.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -82.05 -45.83 14.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.125 -178.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -67.42 -53.6 27.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.168 -178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.57 ' SG ' ' HG2' ' A' ' 65' ' ' ARG . 77.2 m 64.84 98.82 0.04 OUTLIER 'General case' 0 C--O 1.235 0.311 0 O-C-N 123.496 0.498 . . . . 0.0 111.694 -179.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -68.83 144.43 95.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.212 173.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -66.4 130.6 24.21 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.841 2.361 . . . . 0.0 111.746 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.589 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 25.8 mmt -65.88 135.39 54.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.878 -175.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 p -84.14 178.33 7.87 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.883 175.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.02 -50.02 75.68 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 117.672 0.215 . . . . 0.0 110.646 -174.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -53.95 -41.66 68.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.231 0.539 . . . . 0.0 111.102 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.16 -46.86 69.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.949 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.589 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.9 mttt -60.46 -36.99 79.57 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.402 177.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 23.6 ttm180 -65.05 -41.82 94.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.683 0.278 . . . . 0.0 110.307 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -60.97 -42.88 99.16 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.97 177.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.736 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 0.5 OUTLIER -67.92 -32.13 72.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.289 -177.832 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.456 ' HB2' HG22 ' B' ' 205' ' ' VAL . 83.1 p -69.53 -26.86 64.72 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 110.328 173.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 24' ' ' LYS . 82.8 mt -82.93 -46.14 13.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.057 -178.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.736 ' OD2' ' HA ' ' A' ' 18' ' ' LEU . 1.7 p30 -60.46 -41.86 94.98 Favored 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 121.127 -0.229 . . . . 0.0 110.848 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.436 ' HA ' HD12 ' A' ' 25' ' ' LEU . 34.8 mt -61.34 -42.02 92.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-O 120.815 0.341 . . . . 0.0 110.682 177.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -70.19 -25.87 63.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 0.0 111.212 -177.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 52.1 mtpt -78.92 -19.62 51.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.993 0.425 . . . . 0.0 110.59 178.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.608 HD23 HD21 ' A' ' 75' ' ' LEU . 93.9 mt -75.0 138.64 72.74 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.238 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 97.4 Cg_endo -79.93 172.03 14.58 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 123.238 2.625 . . . . 0.0 112.954 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -52.2 -44.44 57.51 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.381 -0.438 . . . . 0.0 113.427 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -47.8 -54.27 12.89 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.325 0.583 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.658 ' HG2' ' SG ' ' A' ' 74' ' ' CYS . 1.5 mptp? -79.87 -31.89 40.38 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.996 -175.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 30' ' ' LEU . 6.2 mt -61.81 -27.16 68.56 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.595 176.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.13 -35.91 79.54 Favored Glycine 0 N--CA 1.446 -0.65 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.867 173.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.463 ' O ' HG13 ' A' ' 36' ' ' ILE . 18.8 tpp180 -79.24 -44.31 22.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.478 0.18 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.548 HG13 HD22 ' A' ' 67' ' ' LEU . 42.8 t -55.16 -52.22 47.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.659 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -63.28 -31.63 53.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.79 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.0 t60 -69.57 -41.13 76.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.96 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.711 HD13 ' HG3' ' A' ' 66' ' ' GLU . 55.6 mt -64.67 -43.0 96.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.139 179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 33' ' ' VAL . 52.3 mt -62.56 -59.25 4.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.476 178.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.533 ' NE2' ' HB2' ' A' ' 47' ' ' SER . 31.3 mt-30 -61.69 -31.81 71.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.0 t -77.02 -47.81 19.64 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 122.162 -0.336 . . . . 0.0 111.183 -177.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.2 mpt_? -67.64 -29.99 69.45 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.97 0.414 . . . . 0.0 110.279 177.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.448 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 33.8 mm-40 -113.32 83.41 6.6 Favored Pre-proline 0 N--CA 1.443 -0.793 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.096 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -65.52 -15.85 51.38 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.024 1.816 . . . . 0.0 111.287 178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.2 m -73.25 -13.87 61.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.55 176.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 64.0 mt -110.21 27.0 10.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.097 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -62.1 -32.69 73.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.254 -176.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -88.9 42.88 1.11 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.153 0.501 . . . . 0.0 110.804 -179.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.533 ' HB2' ' NE2' ' A' ' 38' ' ' GLN . 62.2 m -76.04 92.1 3.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.979 173.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 49' ' ' PRO . 27.6 m-80 -52.54 116.99 9.73 Favored Pre-proline 0 CA--C 1.519 -0.223 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.704 177.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 48' ' ' ASN . 50.2 Cg_exo -54.85 -30.35 67.69 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.113 2.542 . . . . 0.0 113.422 -173.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -76.69 -24.15 53.17 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.143 -178.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -140.28 72.95 1.41 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' B' ' 206' ' ' LYS . 32.2 mt -87.81 125.73 41.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.936 0.398 . . . . 0.0 111.198 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -106.4 117.53 34.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.43 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 205' ' ' VAL . 59.4 mt -93.83 109.12 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 173.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -110.64 100.66 9.41 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.937 0.875 . . . . 0.0 110.629 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -66.98 -6.89 18.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.827 -1.078 . . . . 0.0 112.505 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -81.71 -27.89 33.71 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.718 0.294 . . . . 0.0 111.209 -177.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.1 p -93.4 -24.38 18.09 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.448 ' CD2' ' HG3' ' A' ' 41' ' ' GLU . 36.9 mt -61.04 123.27 17.15 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.618 176.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 2.8 mptt -69.92 148.21 96.22 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.653 177.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -44.75 -33.59 7.29 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 122.507 2.138 . . . . 0.0 113.257 175.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.2 t -60.84 -46.7 89.54 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.496 0.189 . . . . 0.0 110.726 178.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.433 ' O ' ' HG ' ' A' ' 67' ' ' LEU . 1.5 m -65.38 -48.11 74.02 Favored 'General case' 0 CA--C 1.518 -0.254 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 82.3 mt -57.76 -37.85 74.36 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.832 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.57 ' HG2' ' SG ' ' A' ' 7' ' ' CYS . 8.7 tpt180 -71.5 -49.48 40.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.828 178.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.711 ' HG3' HD13 ' A' ' 36' ' ' ILE . 6.8 tp10 -56.28 -48.43 76.63 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.175 0.512 . . . . 0.0 110.164 179.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 71' ' ' VAL . 96.1 mt -57.14 -58.24 9.06 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.312 178.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' VAL . 28.8 tt0 -55.04 -47.85 74.23 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 120.947 0.403 . . . . 0.0 111.004 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -58.04 -36.34 72.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.63 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -80.06 -46.07 17.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.835 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.576 HG21 ' CG ' ' A' ' 21' ' ' ASP . 17.0 m -64.1 -39.41 85.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.14 0.495 . . . . 0.0 110.636 -175.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.583 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 23.9 p -72.14 -34.0 68.2 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.532 -178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 87.5 p -67.98 -17.71 64.52 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.204 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.658 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 43.7 t -91.41 -54.26 3.99 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.663 177.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.608 HD21 HD23 ' A' ' 25' ' ' LEU . 65.7 mt -77.03 -30.34 55.69 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -173.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.583 ' HB2' ' O ' ' A' ' 72' ' ' THR . 68.8 mtp180 -82.09 -5.12 58.16 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.148 0.499 . . . . 0.0 110.297 177.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -99.46 -42.89 6.75 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.43 -0.805 . . . . 0.0 109.367 174.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.526 ' HE3' ' HB2' ' A' ' 82' ' ' GLN . 26.7 tptp -141.69 97.42 3.15 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.334 176.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 33.5 ptt180 -72.35 123.1 22.32 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 173.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.6 tttt 70.67 111.98 0.03 OUTLIER Pre-proline 0 CA--C 1.532 0.285 0 O-C-N 123.873 0.733 . . . . 0.0 110.356 -174.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -54.15 136.76 68.85 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.754 2.303 . . . . 0.0 112.545 179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.526 ' HB2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 tp60 -88.93 110.22 20.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.412 179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.759 -0.638 . . . . 0.0 110.329 179.139 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 120.46 0.171 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 89.1 mt 54.23 38.96 30.32 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.369 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 57.9 tp60 -98.53 121.12 40.07 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.993 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 10.9 p -65.01 -71.65 0.18 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.192 178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 75.7 m -146.37 152.03 38.44 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.409 176.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 1.2 pt -124.83 111.92 29.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.52 178.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . 0.456 HG22 ' HB2' ' A' ' 19' ' ' SER . 12.5 t -95.73 117.19 39.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.174 -177.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 26.9 mttm -106.26 89.02 2.93 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -101.0 137.29 39.56 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.459 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -98.0 116.56 30.47 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.039 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . 0.465 ' HE3' HD13 ' B' ' 211' ' ' LEU . 65.7 tttp -93.18 115.45 65.01 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.071 -174.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -86.75 109.85 0.86 Allowed 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.693 2.262 . . . . 0.0 112.011 176.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.465 HD13 ' HE3' ' B' ' 209' ' ' LYS . 2.3 pt? -152.28 158.54 33.54 Favored Pre-proline 0 C--N 1.323 -0.566 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.56 -67.99 0.07 OUTLIER 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.206 1.937 . . . . 0.0 111.853 176.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -176.61 -72.42 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 178.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 9.7 t -124.34 17.61 9.02 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.402 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 68.73 101.84 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.298 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.729 179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -77.42 58.13 6.19 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.902 2.402 . . . . 0.0 111.944 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.535 -1.147 . . . . 0.0 111.24 178.803 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.8 m . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.909 0.385 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -60.64 -38.43 84.81 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -173.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -64.13 -35.97 82.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.318 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -65.61 -40.43 92.61 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.793 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -76.22 -34.32 59.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.628 178.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.7 tptt -61.83 -37.97 86.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.172 0.51 . . . . 0.0 110.655 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 70.1 m -80.2 100.38 8.27 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.008 -179.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -69.75 146.67 95.87 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.84 174.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -60.01 126.24 19.78 Favored 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.865 2.377 . . . . 0.0 112.173 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.412 ' O ' ' HE3' ' A' ' 15' ' ' LYS . 24.6 mmt -57.08 134.77 56.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.703 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 m -88.67 174.77 7.84 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.182 -0.674 . . . . 0.0 109.182 175.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -56.51 -54.92 40.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -165.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -51.65 -40.06 59.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.657 0.265 . . . . 0.0 111.695 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -65.66 -47.33 75.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.491 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.412 ' HE3' ' O ' ' A' ' 10' ' ' MET . 89.5 mttt -58.52 -41.96 86.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.943 176.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.44 ' O ' ' HG ' ' A' ' 20' ' ' LEU . 29.1 ttp180 -63.48 -46.63 85.29 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.334 177.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -56.81 -45.98 81.9 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.89 -50.92 71.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.412 178.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 95.7 p -58.74 -37.02 75.29 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.975 0.417 . . . . 0.0 110.866 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 16' ' ' ARG . 98.1 mt -70.3 -40.52 74.2 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.653 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.546 ' O ' HD11 ' A' ' 75' ' ' LEU . 63.7 m-20 -67.25 -37.2 83.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.094 179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.28 -40.11 86.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 120.898 0.38 . . . . 0.0 110.719 176.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -72.23 -28.96 63.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.098 0.475 . . . . 0.0 110.563 -178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.653 ' HD3' HD13 ' A' ' 75' ' ' LEU . 46.6 mttp -62.13 -39.0 91.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.692 171.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD23 HD21 ' A' ' 75' ' ' LEU . 96.0 mt -64.47 141.43 98.21 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.787 -175.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HG2' ' HD3' ' A' ' 29' ' ' LYS . 91.4 Cg_endo -82.77 172.08 11.41 Favored 'Trans proline' 0 N--CA 1.461 -0.405 0 C-N-CA 123.479 2.786 . . . . 0.0 112.717 178.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -54.11 -39.41 63.57 Favored Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.886 -177.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.453 ' CD ' ' H ' ' A' ' 28' ' ' GLU . 6.5 mp0 -48.34 -59.53 3.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.73 0.776 . . . . 0.0 111.171 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HD3' ' HG2' ' A' ' 26' ' ' PRO . 1.7 mptp? -77.42 -29.32 52.92 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.022 -176.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -59.6 -29.85 68.26 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.801 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -58.8 -35.06 80.45 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.84 175.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.2 tpp180 -80.69 -38.92 28.09 Favored 'General case' 0 N--CA 1.448 -0.53 0 O-C-N 122.749 -0.266 . . . . 0.0 110.748 177.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.441 ' O ' HG13 ' A' ' 37' ' ' ILE . 61.5 t -55.34 -53.76 32.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 110.548 178.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.5 p -63.78 -30.92 51.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.672 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 17.9 t60 -66.59 -41.26 88.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.101 177.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.51 ' O ' ' HD3' ' A' ' 40' ' ' ARG . 66.0 mt -63.08 -43.17 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.048 178.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.462 HD13 HG23 ' A' ' 54' ' ' ILE . 47.4 mt -64.39 -62.29 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.937 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -60.67 -35.43 76.22 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.2 t -74.02 -36.81 64.47 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.264 -176.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 36' ' ' ILE . 11.0 mpt_? -77.73 -31.84 52.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.271 176.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.439 ' HG3' ' CD2' ' A' ' 59' ' ' LEU . 21.0 mm-40 -117.91 86.37 25.04 Favored Pre-proline 0 N--CA 1.445 -0.678 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.473 -176.128 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.26 -9.72 24.79 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.299 1.999 . . . . 0.0 112.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.4 m -84.47 -3.87 58.61 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.128 0.49 . . . . 0.0 110.393 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 66.8 mt -114.29 29.29 8.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.522 0.677 . . . . 0.0 109.325 176.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -82.19 -9.96 59.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.86 -172.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -100.6 24.12 9.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.379 0.609 . . . . 0.0 110.355 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.6 p -77.87 103.35 7.75 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.337 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -57.61 119.72 35.28 Favored Pre-proline 0 CA--C 1.52 -0.192 0 CA-C-N 115.943 -0.572 . . . . 0.0 109.804 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HA ' HD11 ' A' ' 52' ' ' ILE . 86.4 Cg_exo -51.59 -25.31 19.41 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 123.546 2.83 . . . . 0.0 113.832 -176.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.595 ' O ' ' HG3' ' B' ' 208' ' ' LYS . 18.5 m-20 -77.67 -28.33 51.13 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.433 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -143.03 76.64 1.54 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' A' ' 49' ' ' PRO . 41.9 mt -87.97 129.51 39.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.069 -176.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.421 ' HG3' ' HD3' ' B' ' 206' ' ' LYS . 2.2 mp0 -108.44 123.93 49.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.214 178.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.462 HG23 HD13 ' A' ' 37' ' ' ILE . 17.9 mt -95.74 108.67 21.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 175.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 13.0 p-10 -104.06 97.65 7.59 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 122.008 0.908 . . . . 0.0 110.852 179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -71.57 -0.42 10.6 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.983 -175.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -84.93 -22.13 29.37 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.84 0.352 . . . . 0.0 110.582 -178.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.7 p -102.52 -25.02 13.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.978 0.418 . . . . 0.0 110.078 177.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 55' ' ' ASP . 37.7 mt -57.06 131.83 51.08 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.784 -178.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 18.2 mtmm -75.89 150.55 83.79 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.32 179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -45.8 -41.63 19.82 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.706 2.27 . . . . 0.0 113.31 178.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.8 p -57.72 -48.11 80.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.831 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -62.82 -47.51 83.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.157 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.445 HD21 ' HB2' ' A' ' 59' ' ' LEU . 83.0 mt -57.96 -40.59 80.93 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.987 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.0 tpt180 -68.36 -46.52 69.88 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.271 179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -68.13 -39.71 82.67 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.065 -178.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.614 ' O ' HG13 ' A' ' 71' ' ' VAL . 82.3 mt -57.04 -54.16 49.88 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 174.676 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -57.46 -47.72 81.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.514 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.3 ttp85 -63.76 -27.78 69.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.159 -176.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -79.43 -51.67 9.06 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.11 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.614 HG13 ' O ' ' A' ' 67' ' ' LEU . 5.3 m -66.79 -36.24 76.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 120.712 0.291 . . . . 0.0 110.878 -173.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.476 ' O ' ' HB2' ' A' ' 76' ' ' ARG . 35.1 p -72.37 -38.28 68.57 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.638 178.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.1 p -62.18 -24.19 67.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.235 -0.283 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.443 ' SG ' ' HG2' ' A' ' 29' ' ' LYS . 27.7 t -91.03 -49.95 6.13 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.507 -179.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.653 HD13 ' HD3' ' A' ' 24' ' ' LYS . 71.9 mt -83.23 -21.19 33.47 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -172.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 72' ' ' THR . 35.2 mtp180 -85.96 0.54 52.98 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.412 0.625 . . . . 0.0 109.789 175.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.9 tttm -104.96 -39.02 6.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.673 169.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -152.52 95.69 2.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.351 -0.841 . . . . 0.0 110.095 176.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -69.73 123.79 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 178.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt 60.38 81.72 0.24 Allowed Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.749 -174.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.43 81.62 0.09 OUTLIER 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.135 2.556 . . . . 0.0 112.971 -177.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -118.47 153.54 33.97 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.396 -0.812 . . . . 0.0 110.465 -179.249 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 199' ' ' ASN . . . . . . . . . . . . . 8.8 p30 . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 120.829 0.347 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 200' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.0 27.49 9.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.347 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 201' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -63.54 110.31 1.94 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 173.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 58.3 p -74.26 153.99 39.16 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.215 0.531 . . . . 0.0 111.929 -172.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 11.2 t -81.66 85.16 6.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.259 -179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 204' ' ' ILE . . . . . . . . . . . . . 46.8 mm -68.73 128.05 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.182 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 205' ' ' VAL . . . . . . . . . . . . . 58.6 t -91.74 109.75 21.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.885 0.374 . . . . 0.0 110.657 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 206' ' ' LYS . . . . . 0.421 ' HD3' ' HG3' ' A' ' 53' ' ' GLU . 8.3 tppt? -99.18 83.56 2.88 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 175.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -99.09 158.29 15.77 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.116 0.484 . . . . 0.0 110.637 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 208' ' ' LYS . . . . . 0.595 ' HG3' ' O ' ' A' ' 50' ' ' ASP . 44.4 tttp -110.32 114.92 28.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.233 -178.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 209' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -91.84 129.55 41.79 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 178.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 210' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -60.96 115.86 2.98 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.589 2.193 . . . . 0.0 112.093 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 211' ' ' LEU . . . . . 0.488 HD12 ' HD2' ' B' ' 212' ' ' PRO . 21.3 tp -79.5 133.14 60.16 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.676 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 212' ' ' PRO . . . . . 0.488 ' HD2' HD12 ' B' ' 211' ' ' LEU . 60.5 Cg_endo -72.85 55.45 2.77 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.637 2.225 . . . . 0.0 112.28 178.613 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . . . . . . . . . 43.7 tp -104.16 -11.49 17.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.541 0.686 . . . . 0.0 109.284 177.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 214' ' ' THR . . . . . . . . . . . . . 14.1 t -154.23 148.04 25.45 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.534 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 215' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -132.02 89.78 37.27 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-O 121.063 0.459 . . . . 0.0 110.523 179.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 216' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_exo -72.01 154.14 57.81 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.981 2.454 . . . . 0.0 111.596 175.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 217' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.486 -1.175 . . . . 0.0 111.741 179.987 . . . . . . . . 0 0 . 1 stop_ save_